SCHEMBL4711587

SCHEMBL4711587

CCOC(=O)COc1ccc(C)nc1C=Cc1ccccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.49
MAPT P10636 6/20 0.48
ALDH1A1 P00352 5/20 0.48
RAB9A P51151 5/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
LMNA P02545 4/20 0.48
HPGD P15428 3/20 0.48
NPSR1 Q6W5P4 3/20 0.48
NPC1 O15118 3/20 0.48
MAPK1 P28482 2/20 0.48
TLR9 Q9NR96 2/20 0.48
S1PR4 O95977 1/20 0.48
ITGA4 P13612 1/20 0.48
S1PR1 P21453 1/20 0.48
KDM4E B2RXH2 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
CASP1 P29466 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MITF O75030 1/20 0.43

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
SCHEMBL4711585 1.00 USP2 (0.49) USP2MAPTALDH1A1RAB9ASMN1; SMN2
SCHEMBL4713003 0.88 PTGDR2 (0.45) MAPTRAB9ASMN1; SMN2NPC1KDM4E
SCHEMBL4710664 0.88 PTGDR2 (0.45) MAPTRAB9ASMN1; SMN2NPC1KDM4E
SCHEMBL4710531 0.80 TSHR (0.44) MAPTALDH1A1RAB9ASMN1; SMN2LMNA
SCHEMBL4710729 0.80 TSHR (0.44) MAPTALDH1A1RAB9ASMN1; SMN2LMNA
SCHEMBL4710055 0.80 KMT2A (0.44) USP2MAPTALDH1A1RAB9ASMN1; SMN2
SCHEMBL4710053 0.80 KMT2A (0.44) USP2MAPTALDH1A1RAB9ASMN1; SMN2
SCHEMBL2011265 0.74 USP2 (0.58) USP2MAPTALDH1A1RAB9ASMN1; SMN2
SCHEMBL4713064 0.73 RAB9A (0.46) USP2MAPTALDH1A1RAB9ASMN1; SMN2
SCHEMBL4713060 0.73 RAB9A (0.46) USP2MAPTALDH1A1RAB9ASMN1; 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
EP-0998459-B1 PYRIDINE DERIVATIVES NOVARTIS AG (CH) 2008-04-23 EP claimed
EP-0998459-A2 PYRIDINE DERIVATIVES Novartis AG (CH) 2000-05-10 EP claimed
WO-1999002497-A2 PYRIDINE DERIVATIVES NOVARTIS AG (CH) 1999-01-21 WO claimed
EP-0998459-B1 PYRIDINE DERIVATIVES NOVARTIS AG (CH) 2008-04-23 EP disclosed