Bms-690514

Bms-690514

SCHEMBL1218901

COc1cccc(Nc2ncnn3ccc(CN4CCC(N)C(O)C4)c23)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

EGFRERBB2ERBB4FLT1FLT4KDR

The experimentally established mechanism targets of Bms-690514. 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
EGFR known ✓ P00533 11/20 1.00
ERBB2 known ✓ P04626 10/20 0.61
AAK1 Q2M2I8 10/20 1.00
CIT O14578 1/20 1.00
CHEK1 O14757 1/20 1.00
GAK O14976 1/20 1.00
STK10 O94804 1/20 1.00
PRKD3 O94806 1/20 1.00
ABL1 P00519 1/20 1.00
LCK P06239 1/20 1.00
FYN P06241 1/20 1.00
YES1 P07947 1/20 1.00
LYN P07948 1/20 1.00
RET P07949 1/20 1.00
HCK P08631 1/20 1.00
SRC P12931 1/20 1.00
PHKG2 P15735 1/20 1.00
PRKCA P17252 1/20 1.00
PRKACA P17612 1/20 1.00
CSNK2A2 P19784 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
Bms-690514 SCHEMBL1220743 1.00 EGFR (1.00) EGFRAAK1CITCHEK1GAK
Bms-690514 SCHEMBL1218662 1.00 EGFR (1.00) EGFRAAK1CITCHEK1GAK
Bms-690514 SCHEMBL1218633 1.00 EGFR (1.00) EGFRAAK1CITCHEK1GAK
Bms-690514 SCHEMBL29385871 1.00 EGFR (1.00) EGFRAAK1CITCHEK1GAK
Bms-690514 SCHEMBL1219326 1.00 EGFR (1.00) EGFRAAK1CITCHEK1GAK
Bms-690514 SCHEMBL13709054 1.00 EGFR (1.00) EGFRAAK1CITCHEK1GAK
SCHEMBL1220267 0.93 EGFR (0.86) EGFRAAK1CITCHEK1GAK
SCHEMBL1220192 0.93 EGFR (0.86) EGFRAAK1CITCHEK1GAK
SCHEMBL1220194 0.93 EGFR (0.86) EGFRAAK1CITCHEK1GAK
SCHEMBL1220185 0.91 AAK1 (0.84) EGFRAAK1CITCHEK1GAK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019201123-A1 MULTIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN PHARMACEUTICALS 四川科伦博泰生物医药股份有限公司 2019-10-24 WO disclosed
EP-2968590-A1 ANTIBODY DRUG CONJUGATES Novartis AG (CH) 2016-01-20 EP disclosed
WO-2014150937-A1 ANTIBODY DRUG CONJUGATES NOVARTIS AG (CH) 2014-09-25 WO disclosed
US-20110039838-A1 PYRROLOTRIAZINE COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2011-02-17 US disclosed
US-7846931-B2 Pyrrolotriazine compounds as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-12-07 US disclosed
EP-1699797-B1 PYRROLOTRIAZINE COMPOUNDS AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2009-09-23 EP disclosed
EP-2058314-A1 Pyrrolotriazine compounds as kinase inhibitors Bristol-Myers Squibb Company (US) 2009-05-13 EP disclosed
US-20090048244-A1 PYRROLOTRIAZINE COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2009-02-19 US disclosed
EP-1989207-A1 CRYSTALLINE FORMS OF (3R,4R)-4-AMINO-1-[[4-[(3-METHOXYPHENYL)AMINO]PYRROLO[2,1-F][1,2,4]TRIAZIN-5-YL]METHOL]PIPERIDIN-3-OL Bristol-Myers Squibb Company (US) 2008-11-12 EP disclosed
US-7297695-B2 Pyrrolotriazine compounds as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-11-20 US disclosed
WO-2007095632-A1 CRYSTALLINE FORMS OF (3R,4R)-4-AMINO-1-[[4-[(3-METHOXYPHENYL)AMINO]PYRROLO[2,1-F][1,2,4]TRIAZIN-5-YL]METHOL]PIPERIDIN-3-OL BRISTOL-MYERS SQUIBB COMPANY (US) 2007-08-23 WO disclosed
US-7141571-B2 Pyrrolotriazine compounds as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2006-11-28 US disclosed
US-20060264438-A1 PYRROLOTRIAZINE COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2006-11-23 US disclosed
US-20050182058-A1 Pyrrolotriazine compounds as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2005-08-18 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 (4 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-20110039838-A1 PYRROLOTRIAZINE COMPOUNDS AS KINASE INHIBITORS ERBB2, ERBB4, ERBB3 EGFR 4/4885ERBB2 1/4885AAK1 123/4885
US-20060264438-A1 PYRROLOTRIAZINE COMPOUNDS AS KINASE INHIBITORS ERBB2, ERBB4, ERBB3 EGFR 4/4885ERBB2 1/4885AAK1 123/4885
US-20050182058-A1 Pyrrolotriazine compounds as kinase inhibitors ERBB2, ERBB4, ERBB3 EGFR 4/4885ERBB2 1/4885AAK1 123/4885
US-20090048244-A1 PYRROLOTRIAZINE COMPOUNDS AS KINASE INHIBITORS ERBB2, ERBB4, ERBB3 EGFR 4/4885ERBB2 1/4885AAK1 123/4885

“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.