SCHEMBL9470451

SCHEMBL9470451

ClCc1cccnc1Nc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 4/20 0.51
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
MAPT P10636 3/20 0.47
ALDH1A1 P00352 2/20 0.47
GAA P10253 1/20 0.47
GRM4 Q14833 1/20 0.45
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ABCG2 Q9UNQ0 2/20 0.42
CLK1 P49759 1/20 0.39
BCL6 P41182 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
EPAS1 Q99814 1/20 0.39
DAPK3 O43293 1/20 0.39
MAP4K4 O95819 1/20 0.39
ABL1 P00519 1/20 0.39
EGFR P00533 1/20 0.39
ERBB2 P04626 1/20 0.39

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
SCHEMBL9469995 0.86 RAB9A (0.55) DHODHKMT2AMEN1ALDH1A1RAB9A
SCHEMBL1375014 0.82 DHODH (0.56) DHODHKMT2AMEN1MAPTALDH1A1
SCHEMBL5252795 0.82 DHODH (0.51) DHODHKMT2AMEN1MAPTALDH1A1
SCHEMBL1908379 0.82 DHODH (0.56) DHODHKMT2AMEN1MAPTALDH1A1
SCHEMBL3633702 0.78 DHODH (0.51) DHODHKMT2AMEN1MAPTALDH1A1
SCHEMBL9753940 0.78 BRD4 (0.48) DHODHKMT2AMEN1MAPTALDH1A1
SCHEMBL27975923 0.78 DHODH (0.47) DHODHKMT2AMEN1MAPTALDH1A1
SCHEMBL14604182 0.76 DHODH (0.56) DHODHKMT2AMEN1MAPTALDH1A1
SCHEMBL28045414 0.76 GRM5 (0.37) KMT2AMAPTALDH1A1GRM4RAB9A
SCHEMBL16024049 0.76 DHODH (0.56) DHODHKMT2AMEN1MAPTALDH1A1

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