SCHEMBL722802

SCHEMBL722802

CCN(CC)C(C(N)=O)n1c(C)c(C(=O)O)c(C)c1C=C1C(=O)Nc2ccc(F)cc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 2/20 0.52
▸ KDR P35968 9/20 0.46
▸ PRKAA1 Q13131 7/20 0.46
▸ PDGFRB P09619 7/20 0.46
▸ PRKAA2 P54646 6/20 0.46
▸ FLT3 P36888 6/20 0.46
▸ CSF1R P07333 3/20 0.46
▸ TLK2 Q86UE8 3/20 0.46
▸ FGFR1 P11362 3/20 0.46
▸ PLK4 O00444 2/20 0.46
▸ DCLK1 O15075 2/20 0.46
▸ PDPK1 O15530 2/20 0.46
▸ DAPK3 O43293 2/20 0.46
▸ ROCK2 O75116 2/20 0.46
▸ RPS6KA5 O75582 2/20 0.46
▸ RPS6KA4 O75676 2/20 0.46
▸ MAP4K4 O95819 2/20 0.46
▸ CHEK2 O96017 2/20 0.46
▸ NTRK1 P04629 2/20 0.46
▸ INSR P06213 2/20 0.46

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
SCHEMBL2116963 0.90 PDGFRB (0.46) ALKKDRPRKAA1PDGFRBPRKAA2
SCHEMBL5518078 0.89 ALK (0.50) ALKKDRPRKAA1PDGFRBPRKAA2
SCHEMBL2114116 0.88 LRRK2 (0.42) ALKKDRPRKAA1PDGFRBPRKAA2
SCHEMBL2115792 0.86 NTRK1 (0.43) ALKKDRPDGFRBFLT3FGFR1
SCHEMBL6725660 0.84 ALK (0.52) ALKKDRPRKAA1PDGFRBPRKAA2
SCHEMBL2114117 0.83 KDR (0.46) KDRPDGFRBFLT3FGFR1SRC
SCHEMBL2116248 0.81 KDR (0.40) KDRPRKAA1PDGFRBPRKAA2FLT3
SCHEMBL1673441 0.81 ALK (0.52) ALKKDRPRKAA1PDGFRBPRKAA2
SCHEMBL398243 0.81 TLK2 (0.48) KDRFLT3TLK2PDPK1NTRK1
SCHEMBL2115891 0.80 MEN1 (0.48) ALKKDRPDGFRBFGFR1PLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110207756-A1 ANTITUMOR AGENT FOR THYROID CANCER EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-08-25 — — US claimed
EP-2119707-A1 COMPOSITION FOR TREATMENT OF UNDIFFERENTIATED-TYPE OF GASTRIC CANCER Eisai R&D Management Co., Ltd. (JP) 2009-11-18 — — EP claimed
US-20090264464-A1 ANTITUMOR AGENT FOR UNDIFFERENTIATED GASTRIC CANCER EISAI R & D MANAGEMENT CO., LTD. (JP) 2009-10-22 — — US claimed
US-20090209580-A1 ANTITUMOR AGENT FOR THYROID CANCER EISAI R & D MANAGEMENT CO., LTD. (JP) 2009-08-20 — — US claimed
EP-2065372-A1 ANTITUMOR AGENT FOR UNDIFFERENTIATED GASTRIC CANCER Eisai R&D Management Co., Ltd. (JP) 2009-06-03 — — EP claimed
EP-2036557-A1 ANTITUMOR AGENT FOR THYROID CANCER Eisai R&D Management Co., Ltd. (JP) 2009-03-18 — — EP claimed
US-20040152759-A1 Combination administration of an indolinone with a chemotherapeutic agent for cell proliferation disorders SUGEN, INC. 2004-08-05 — — US claimed
EP-2036557-B1 ANTITUMOR AGENT FOR THYROID CANCER EISAI R&D MAN CO LTD (JP) 2015-10-21 — — EP disclosed
US-9006256-B2 Antitumor agent for thyroid cancer EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-14 — — US disclosed
US-8962655-B2 Composition for treatment of undifferentiated gastric cancer EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-02-24 — — US disclosed
US-8865737-B2 Antitumor agent for undifferentiated gastric cancer EISAI R&D MANAGEMENT CO., LTD. (JP) 2014-10-21 — — US disclosed
EP-2065372-B1 ANTITUMOR AGENT FOR UNDIFFERENTIATED GASTRIC CANCER EISAI R&D MAN CO LTD (JP) 2012-11-28 — — EP disclosed
US-20120094998-A1 Oligomer-Protein Tyrosine Kinase Inhibitor Conjugates NEKTAR THERAPEUTICS (US) 2012-04-19 — — US disclosed
US-6573293-B2 Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN, INC. 2003-06-03 — — US disclosed
WO-2003015608-A2 COMBINATION THERAPY FOR THE TREATMENT OF CANCER SUGEN, INC. (US) 2003-02-27 — — WO disclosed
EP-1259514-A2 3-(PYROLYLLACTONE)-2-INDOLINONE COMPOUNDS AS KINASE INHIBITORS Sugen, Inc. (US) 2002-11-27 — — EP disclosed
US-20020156292-A1 Pyrrole substituted 2-indolinone protein kinase inhibitors PHARMACIA & UPJOHN COMPANY LLC 2002-10-24 — — US disclosed
US-6465507-B2 ANTITUMOR AGENTS SUGEN, INC. 2002-10-15 — — US disclosed
US-20020042427-A1 3-(pyrolyllactone)-2-indolinone compounds as kinase inhibitors SUGEN, INC. 2002-04-11 — — US disclosed
WO-2001064681-A2 3-(PYROLYLLACTONE)-2-INDOLINONE COMPOUNDS AS KINASE INHIBITORS SUGEN, INC. (US) 2001-09-07 — — WO disclosed

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

For each of this compound's patents that has machine-readable text (7 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-20090209580-A1 ANTITUMOR AGENT FOR THYROID CANCER MEN1, VHL, NTSR2 ALK 4653/4885KDR 2455/4885PRKAA1 2909/4885
US-20040152759-A1 Combination administration of an indolinone with a chemotherapeutic agent for cell proliferation disorders MKI67, CCNA1, CCNI ALK 4375/4885KDR 3687/4885PRKAA1 3094/4885
US-20120094998-A1 Oligomer-Protein Tyrosine Kinase Inhibitor Conjugates PTK2B, ERBB2, FRK ALK 191/4885KDR 395/4885PRKAA1 881/4885
US-20090264464-A1 ANTITUMOR AGENT FOR UNDIFFERENTIATED GASTRIC CANCER FGFR2, FGFR3, FGF2 ALK 706/4885KDR 340/4885PRKAA1 1808/4885
US-20020042427-A1 3-(pyrolyllactone)-2-indolinone compounds as kinase inhibitors MAP3K20, MAP3K6, MAP3K3 ALK 774/4885KDR 936/4885PRKAA1 298/4885
US-20110207756-A1 ANTITUMOR AGENT FOR THYROID CANCER MEN1, VHL, NTSR2 ALK 4653/4885KDR 2455/4885PRKAA1 2909/4885
US-20020156292-A1 Pyrrole substituted 2-indolinone protein kinase inhibitors PDPK1, MAP3K20, PLK2 ALK 1177/4885KDR 1372/4885PRKAA1 75/4885

“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.

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