Orantinib

Orantinib

SCHEMBL134661

Cc1[nH]c(/C=C2\C(=O)Nc3ccccc32)c(C)c1CCC(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

FGFR1FGFR2FGFR3FGFR4KDRPDGFRAPDGFRB

The experimentally established mechanism targets of Orantinib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 known ✓ P11362 16/20 1.00
KDR known ✓ P35968 16/20 1.00
PDGFRB known ✓ P09619 16/20 1.00
FGFR3 known ✓ P22607 1/20 1.00
FLT1 P17948 3/20 1.00
AURKA O14965 2/20 1.00
RET P07949 2/20 1.00
FLT3 P36888 2/20 1.00
MAP4K2 Q12851 2/20 1.00
STK3 Q13188 2/20 1.00
AURKB Q96GD4 2/20 1.00
ZAP70 P43403 2/20 1.00
GAK O14976 1/20 1.00
RPS6KA5 O75582 1/20 1.00
RPS6KA4 O75676 1/20 1.00
LATS1 O95835 1/20 1.00
CSNK2A2 P19784 1/20 1.00
MAP2K2 P36507 1/20 1.00
MAP2K1 Q02750 1/20 1.00
STK4 Q13043 1/20 1.00

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Orantinib SCHEMBL134662 1.00 FGFR1 (1.00) FGFR1KDRPDGFRBFLT1AURKA
Orantinib SCHEMBL900355 1.00 FGFR1 (1.00) FGFR1KDRPDGFRBFLT1AURKA
Orantinib SCHEMBL29354645 1.00 FGFR1 (1.00) FGFR1KDRPDGFRBFLT1AURKA
SCHEMBL12020869 0.91 KDR (0.84) FGFR1KDRPDGFRBFLT1AURKA
SCHEMBL25717271 0.90 KDR (0.82) FGFR1KDRPDGFRBFLT1AURKA
SCHEMBL26023377 0.88 KDR (0.79) FGFR1KDRPDGFRBFLT1AURKA
SCHEMBL13497857 0.88 KDR (0.79) FGFR1KDRPDGFRBFLT1AURKA
SCHEMBL4408686 0.88 KDR (1.00) FGFR1KDRPDGFRBFLT1AURKA
SCHEMBL29678231 0.88 KDR (1.00) FGFR1KDRPDGFRBFLT1AURKA
SCHEMBL30676938 0.88 KDR (1.00) FGFR1KDRPDGFRBFLT1AURKA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 310 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11331272-B2 Hyperstabilized liposomes increase targeting of mitotic cells TEMASEK LIFE SCIENCES LABORATORY LIMITED (SG) 2022-05-17 US claimed
EP-3400210-B1 \"MULTI-TARGET\" COMPOUNDS WITH INHIBITORY ACTIVITY TOWARDS HISTONE DEACETYLASES AND TUBULIN POLYMERISATION, FOR USE IN THE TREATMENT OF CANCER UNIV PARIS SACLAY (FR) 2021-09-29 EP claimed
US-11014871-B2 “Multi-target” compounds with inhibitory activity towards histone deacetylases and tubulin polymerisation, for use in the treatment of cancer CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2021-05-25 US claimed
US-10744141-B2 Compositions and methods for treating cancer CASE WESTERN RESERVE UNIVERSITY (US) 2020-08-18 US claimed
WO-2019057920-A1 BORONATE ESTER CROSSLINKED NANOGELS BASED ON MODIFIED POLYSACCHARIDES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2019-03-28 WO claimed
EP-2142493-B1 ISO CA-4 AND ANALOGUES THEREOF AS POTENT CYTOTOXIC AGENTS INHIBITING TUBULINE POLYMERISATION CENTRE NAT RECH SCIENT (FR) 2019-03-27 EP claimed
US-20190023645-A1 \"MULTI-TARGET\" COMPOUNDS WITH INHIBITORY ACTIVITY TOWARDS HISTONE DEACETYLASES AND TUBULIN POLYMERISATION, FOR USE IN THE TREATMENT OF CANCER UNIVERSITE PARIS-SUD (FR) 2019-01-24 US claimed
EP-3400210-A2 \"MULTI-TARGET\" COMPOUNDS WITH INHIBITORY ACTIVITY TOWARDS HISTONE DEACETYLASES AND TUBULIN POLYMERISATION, FOR USE IN THE TREATMENT OF CANCER Universite Paris-Sud (FR) 2018-11-14 EP claimed
EP-2786765-B1 Composition for combination therapy comprising an anti-C-met antibody and a FGFR inhibitor SAMSUNG ELECTRONICS CO LTD (KR) 2018-10-03 EP claimed
US-20180185382-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER CASE WESTERN RESERVE UNIVERSITY 2018-07-05 US claimed
US-20040018528-A1 Novel biomarkers of tyrosine kinase inhibitor exposure and activity in mammals SUGEN, INC. 2004-01-29 US claimed
WO-2003097854-A2 NOVEL BIOMARKERS OF TYROSINE KINASE INHIBITOR EXPOSURE AND ACTIVITY IN MAMMALS SUGEN, INC. (US) 2003-11-27 WO claimed
US-20030105151-A1 Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN, INC. 2003-06-05 US claimed
US-20020119198-A1 Self-emulsifying drug delivery systems for extremely water-insoluble, lipophilic drugs PHARMACIA & UPJOHN COMPANY 2002-08-29 US claimed
EP-1233943-A2 IONIZABLE INDOLINONE DERIVATIVES AND THEIR USE AS PTK LIGANDS Sugen, Inc. (US) 2002-08-28 EP claimed
US-6395734-B1 ANTICANCER AGENTS SUGEN, INC. 2002-05-28 US claimed
WO-2001037820-A2 IONIZABLE INDOLINONE DERIVATIVES AND THEIR USE AS PTK LIGANDS SUGEN, INC. (US) 2001-05-31 WO claimed
EP-1066257-A2 HETEROCYLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE Sugen, Inc. (US) 2001-01-10 EP claimed
WO-1999048868-A9 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN INC (US) 2000-04-20 WO claimed
WO-1999048868-A2 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN, INC. (US) 1999-09-30 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030105151-A1 Pyrrole substituted 2-indolinone protein kinase inhibitors DMPK, PDPK1, PLK2 FGFR1 930/4885KDR 1066/4885PDGFRB 1086/4885
US-20180185382-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER PPP2CA, PPP3CA, PPP4C FGFR1 3484/4885KDR 4298/4885PDGFRB 2913/4885
US-10744141-B2 Compositions and methods for treating cancer PPP2CA, PPP3CA, PPP4C FGFR1 3484/4885KDR 4298/4885PDGFRB 2913/4885
US-20020119198-A1 Self-emulsifying drug delivery systems for extremely water-insoluble, lipophilic drugs LIPA, ABCG2, LIPG FGFR1 3688/4885KDR 1068/4885PDGFRB 2114/4885
US-20190023645-A1 \"MULTI-TARGET\" COMPOUNDS WITH INHIBITORY ACTIVITY TOWARDS HISTONE DEACETYLASES AND TUBULIN POLYMERISATION, FOR USE IN THE TREATMENT OF CANCER HDAC6, HDAC1, HDAC5 FGFR1 995/4885KDR 3137/4885PDGFRB 1927/4885
US-11014871-B2 “Multi-target” compounds with inhibitory activity towards histone deacetylases and tubulin polymerisation, for use in the treatment of cancer HDAC6, HDAC1, HDAC5 FGFR1 1186/4885KDR 3315/4885PDGFRB 1953/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.