SCHEMBL9469355

SCHEMBL9469355

Clc1ccc(Nc2ncccc2CSc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
RAB9A P51151 1/20 0.51
DHODH Q02127 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
FLT1 P17948 6/20 0.44
KDR P35968 5/20 0.44
BRD4 O60885 1/20 0.43
CIT O14578 1/20 0.42
EGFR P00533 1/20 0.42
HLA-A P04439 1/20 0.42
CSF1R P07333 1/20 0.42
RET P07949 1/20 0.42
PDGFRB P09619 1/20 0.42
KIT P10721 1/20 0.42
PDGFRA P16234 1/20 0.42
RPS6KB1 P23443 1/20 0.42
FLT4 P35916 1/20 0.42
FRK P42685 1/20 0.42
CDK8 P49336 1/20 0.42

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
SCHEMBL9753940 0.90 BRD4 (0.48) KMT2AMEN1RAB9ADHODHSMN1; SMN2
SCHEMBL4690949 0.88 GRM4 (0.45) KMT2AMEN1RAB9ADHODHSMN1; SMN2
SCHEMBL9754131 0.84 DHODH (0.42) KMT2AMEN1RAB9ADHODHSMN1; SMN2
SCHEMBL9469995 0.79 RAB9A (0.55) KMT2AMEN1RAB9ADHODHSMN1; SMN2
SCHEMBL9402422 0.78 RAB9A (0.57) KMT2AMEN1RAB9ADHODHSMN1; SMN2
SCHEMBL11598545 0.75 MAPT (0.47) KMT2AMEN1RAB9ASMN1; SMN2METAP2
Toluene SCHEMBL27877192 0.75 RAB9A (0.48) KMT2AMEN1RAB9ADHODHSMN1; SMN2
SCHEMBL11598546 0.72 L3MBTL1 (0.42) KMT2AMEN1RAB9ASMN1; SMN2METAP2
SCHEMBL9470451 0.72 DHODH (0.51) KMT2AMEN1RAB9ADHODHSMN1; SMN2
SCHEMBL9837351 0.71 RAB9A (0.57) KMT2AMEN1RAB9ADHODHSMN1; SMN2

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-5182289-A Pyrrolo 2,3-b!Pyridin-2-one Derivatives SCHERING CORPORATION (US) 1993-01-26 US disclosed
EP-0419561-A1 HETEROBICYCLIC COMPOUNDS HAVING ANTIINFLAMMATORY ACTIVITY SCHERING CORPORATION (US) 1991-04-03 EP disclosed
WO-1989012637-A1 HETEROBICYCLIC COMPOUNDS HAVING ANTIINFLAMMATORY ACTIVITY SCHERING CORPORATION (US) 1989-12-28 WO disclosed
EP-0347698-A1 Heterobicyclic compounds having antiinflammatory activity SCHERING CORPORATION (US) 1989-12-27 EP disclosed