SCHEMBL5429344

SCHEMBL5429344

N#Cc1cccc(N/C=C2\C(=O)Nc3cc(-c4ccco4)ccc32)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.46
RET P07949 1/20 0.43
TDP2 O95551 2/20 0.39
SLK Q9H2G2 10/20 0.38
MDM2 Q00987 2/20 0.37
STK10 O94804 8/20 0.37
KDR P35968 1/20 0.35
PDPK1 O15530 1/20 0.35
RPS6KA3 P51812 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
GLA P06280 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
APEX1 P27695 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL5429349 1.00 CHEK1 (0.46) CHEK1RETTDP2SLKMDM2
SCHEMBL5435808 0.84 CHEK1 (0.59) CHEK1SLKMDM2STK10KDR
SCHEMBL5435813 0.84 CHEK1 (0.59) CHEK1SLKMDM2STK10KDR
SCHEMBL7706679 0.83 RET (0.42) CHEK1RETTDP2KDRRPS6KA3
SCHEMBL7706680 0.83 RET (0.42) CHEK1RETTDP2KDRRPS6KA3
SCHEMBL5427646 0.82 RET (0.42) CHEK1RETTDP2PDPK1
SCHEMBL5171570 0.82 RET (0.42) CHEK1RETTDP2PDPK1
SCHEMBL5873782 0.82 FLT1 (0.35) CHEK1RETTDP2SLKSTK10
SCHEMBL5873781 0.82 FLT1 (0.35) CHEK1RETTDP2SLKSTK10
SCHEMBL7703527 0.81 RET (0.46) CHEK1RETTDP2KDRRPS6KA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6350747-B1 PROTEIN SERINE/THREONINE KINASE AND PROTEIN TYROSINE KINASE ENZYME INHIBITORS; ANGIOGENESIS INHIBITORS; ANTITUMOR AND ANTIPROLIFERATIVE AGENTS GLAXO WELLCOME INC. 2002-02-26 US claimed
EP-1165514-A1 3-(ANILINOMETHYLENE) OXINDOLES AS PROTEIN TYROSINE KINASE AND PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2002-01-02 EP claimed
WO-2000056710-A1 3-(ANILINOMETHYLENE) OXINDOLES AS PROTEIN TYROSINE KINASE AND PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2000-09-28 WO claimed
US-20070213403-A1 TAMOXIFEN RESPONSE IN PRE-AND POSTMENOPAUSAL BREAST CANCER PATIENTS FORSKARPATENT I SYD AB (SE) 2007-09-13 US disclosed