SCHEMBL7370169

SCHEMBL7370169

CC(=O)Nc1cc(Cl)cn(C2=CC(C)(C)Oc3ccncc32)c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHUK O15111 1/20 0.37
AAK1 Q2M2I8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
FGFR1 P11362 1/20 0.31
CCNC P24863 3/20 0.31
CDK8 P49336 3/20 0.31
HASPIN Q8TF76 3/20 0.31
CDK19 Q9BWU1 3/20 0.31
DYRK1A Q13627 1/20 0.31
ABL1 P00519 2/20 0.30
PDGFRB P09619 2/20 0.30
SRC P12931 2/20 0.30
PDGFRA P16234 2/20 0.30
MAPK14 Q16539 2/20 0.30
LIMK1 P53667 1/20 0.30
ICOSLG O75144 1/20 0.30
ICOS Q9Y6W8 1/20 0.30
WEE1 P30291 1/20 0.30
PTK2 Q05397 1/20 0.30

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
SCHEMBL7374768 0.92 CHUK (0.37) CHUKAAK1CCNCCDK8HASPIN
SCHEMBL7373225 0.89 CCNC (0.32) AAK1CCNCCDK8HASPINCDK19
SCHEMBL7377524 0.85 WEE1 (0.37) AAK1FGFR1CCNCCDK8HASPIN
SCHEMBL7290178 0.84 CYP11B2 (0.32) KDM4EFGFR1CCNCCDK8HASPIN
SCHEMBL7296855 0.83 SMN1; SMN2 (0.34) AAK1KDM4EHSD17B10FGFR1CCNC
SCHEMBL7293801 0.82 AURKA (0.32) KDM4ECCNCCDK8HASPINCDK19
SCHEMBL8084419 0.81 CFTR (0.38) FGFR1SRC
SCHEMBL8088696 0.81 PDE4A (0.37) KDM4E
SCHEMBL7372821 0.81 S100A4 (0.36) PTK2
SCHEMBL7371406 0.81 CCNC (0.37) AAK1CCNCCDK8HASPINCDK19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0308792-B1 AZACHROMANE DERIVATIVES MERCK PATENT GmbH (DE) 1993-07-28 EP disclosed
US-4931454-A Azachroman derivatives with effects on the cardiovascular system MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-06-05 US disclosed