SCHEMBL8210235

SCHEMBL8210235

CC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 2/20 0.83
▸ AURKA O14965 2/20 0.71
▸ PRKAA1 Q13131 7/20 0.70
▸ PRKAA2 P54646 6/20 0.70
▸ KDR P35968 10/20 0.69
▸ TLK2 Q86UE8 3/20 0.69
▸ PDGFRB P09619 11/20 0.68
▸ FGFR1 P11362 7/20 0.68
▸ FLT1 P17948 2/20 0.68
▸ HDAC3 O15379 3/20 0.67
▸ HDAC4 P56524 3/20 0.67
▸ HDAC1 Q13547 3/20 0.67
▸ HDAC7 Q8WUI4 3/20 0.67
▸ HDAC2 Q92769 3/20 0.67
▸ HDAC10 Q969S8 3/20 0.67
▸ HDAC11 Q96DB2 3/20 0.67
▸ HDAC8 Q9BY41 3/20 0.67
▸ HDAC6 Q9UBN7 3/20 0.67
▸ HDAC9 Q9UKV0 3/20 0.67
▸ HDAC5 Q9UQL6 3/20 0.67

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
SCHEMBL859966 0.91 ALK (1.00) ALKAURKAPRKAA1PRKAA2KDR
SCHEMBL859965 0.91 ALK (1.00) ALKAURKAPRKAA1PRKAA2KDR
SCHEMBL1081676 0.90 ALK (0.82) ALKAURKAPRKAA1PRKAA2KDR
SCHEMBL30733142 0.90 ALK (0.82) ALKAURKAPRKAA1PRKAA2KDR
SCHEMBL12329173 0.90 ALK (0.82) ALKAURKAPRKAA1PRKAA2KDR
SCHEMBL18814394 0.90 ALK (0.82) ALKAURKAPRKAA1PRKAA2KDR
SCHEMBL29486525 0.90 ALK (0.82) ALKAURKAPRKAA1PRKAA2KDR
SCHEMBL17503076 0.90 ALK (0.82) ALKAURKAPRKAA1PRKAA2KDR
SCHEMBL16085063 0.89 ALK (0.80) ALKAURKAPRKAA1PRKAA2KDR
SCHEMBL13960772 0.88 ALK (0.78) ALKAURKAPRKAA1PRKAA2KDR

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9206163-B2 Process for the preparation of sunitinib and its acid addition salts thereof LAURUS LABS PRIVATE LTD. (IN) 2015-12-08 — — US disclosed
US-9206163-B2 Process for the preparation of sunitinib and its acid addition salts thereof LAURUS LABS PRIVATE LTD. (IN) 2015-12-08 — — US disclosed
US-20150025252-A1 PROCESS FOR THE PERPARATION OF SUNITINIB AND ITS ACID ADDITION SALTS THEREOF LAURUS LABS LIMITED (IN) 2015-01-22 — — US disclosed
US-20150025252-A1 PROCESS FOR THE PERPARATION OF SUNITINIB AND ITS ACID ADDITION SALTS THEREOF LAURUS LABS LIMITED (IN) 2015-01-22 — — US disclosed
US-8846953-B2 Processes for the preparation of 3-(pyrrol-2-yl)methylene)-2-pyrrolones using 2-silyloxy-pyrroles SCINOPHARM TAIWAN, LTD. (TW) 2014-09-30 — — US disclosed
US-8846953-B2 Processes for the preparation of 3-(pyrrol-2-yl)methylene)-2-pyrrolones using 2-silyloxy-pyrroles SCINOPHARM TAIWAN, LTD. (TW) 2014-09-30 — — US disclosed
US-8524709-B2 Kinase inhibitor compounds TYROGENEX, INC. (US) 2013-09-03 — — US disclosed
US-20130190512-A1 PROCESSES FOR THE PREPARATION OF 3-(PYRROL-2-YL)METHYLENE)-2-PYRROLONES USING 2-SILYLOXY-PYRROLES SCINOPHARM TAIWAN, LTD. (TW) 2013-07-25 — — US disclosed
US-20130190512-A1 PROCESSES FOR THE PREPARATION OF 3-(PYRROL-2-YL)METHYLENE)-2-PYRROLONES USING 2-SILYLOXY-PYRROLES SCINOPHARM TAIWAN, LTD. (TW) 2013-07-25 — — US disclosed
US-20110224212-A1 KINASE INHIBITOR COMPOUNDS TYROGENEX, INC. (US) 2011-09-15 — — US disclosed
EP-1670785-B1 SALTS AND POLYMORPHS OF A PYRROLE-SUBSTITUTED INDOLINONE COMPOUND PHARMACIA & UPJOHN CO LLC (US) 2010-07-07 — — EP disclosed
US-20100160646-A1 PROCESSES FOR PREPARING SUNITINIB AND SALTS THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2010-06-24 — — US disclosed
US-20090247767-A1 PROCESSES FOR PREPARING SUNITINIB AND SALTS THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-10-01 — — US disclosed
WO-2008033743-A1 SUBSTITUTED 2-INDOLINONE AS PTK INHIBITORS CONTAINING A ZINC BINDING MOIETY CURIS, INC. (US) 2008-03-20 — — WO disclosed
US-7247627-B2 non-hygroscopic, crystalline anhydrous maleate salt of 5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene) methyl]-N-[(2S)-2-hydroxy-3-morpholin-4-ylpropyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide PHARMACIA & UPJOHN COMPANY (US) 2007-07-24 — — US 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 (5 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-20130190512-A1 PROCESSES FOR THE PREPARATION OF 3-(PYRROL-2-YL)METHYLENE)-2-PYRROLONES USING 2-SILYLOXY-PYRROLES SKP2, SDHA, MDH2 ALK 530/4885AURKA 52/4885PRKAA1 2135/4885
US-20100160646-A1 PROCESSES FOR PREPARING SUNITINIB AND SALTS THEREOF KDR, ABL1, FLT4 ALK 72/4885AURKA 123/4885PRKAA1 1049/4885
US-20090247767-A1 PROCESSES FOR PREPARING SUNITINIB AND SALTS THEREOF KDR, ABL1, FLT4 ALK 72/4885AURKA 123/4885PRKAA1 1049/4885
US-20110224212-A1 KINASE INHIBITOR COMPOUNDS MAP3K1, MAP3K20, MAP3K2 ALK 479/4885AURKA 335/4885PRKAA1 59/4885
US-20150025252-A1 PROCESS FOR THE PERPARATION OF SUNITINIB AND ITS ACID ADDITION SALTS THEREOF SUN2, FGFR3, FGFR4 ALK 1754/4885AURKA 141/4885PRKAA1 1808/4885

“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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