SCHEMBL7699501

SCHEMBL7699501

CCc1ccc(C(=O)Nc2ccc(-c3oc(-c4ccccc4)nc3C(=O)N3CCN(c4ccccc4)CC3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.55
DGAT1 O75907 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
POLB P06746 1/20 0.47
USP2 O75604 3/20 0.47
LMNA P02545 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
REV1 Q9UBZ9 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL7696391 0.91 MAPT (0.54) MAPTDGAT1L3MBTL1USP2NPSR1
SCHEMBL7699504 0.91 MAPT (0.55) MAPTDGAT1L3MBTL1LMNAMAPK1
SCHEMBL7697612 0.89 L3MBTL1 (0.60) MAPTDGAT1L3MBTL1MAPK1HTT
SCHEMBL7697604 0.88 KDM4E (0.55) MAPTDGAT1L3MBTL1POLBNPC1
SCHEMBL7703296 0.88 DGAT1 (0.51) MAPTDGAT1L3MBTL1POLBUSP2
SCHEMBL7695332 0.85 NPC1 (0.56) MAPTDGAT1L3MBTL1POLBUSP2
SCHEMBL7697962 0.85 L3MBTL1 (0.56) MAPTDGAT1L3MBTL1POLBNPC1
SCHEMBL7695331 0.84 USP2 (0.57) MAPTDGAT1L3MBTL1POLBUSP2
SCHEMBL7699160 0.84 SMN1; SMN2 (0.57) MAPTDGAT1POLBUSP2LMNA
SCHEMBL7701088 0.84 MAPT (0.53) MAPTDGAT1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO disclosed