SCHEMBL3150480

SCHEMBL3150480

COc1cc2c(cc1OC)CCN(C(=O)CCNCCC1Cc3cc(OC)c(OC)cc3C1)CC2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.51
DPP8 Q6V1X1 1/20 0.51
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 6/20 0.45
ALDH1A1 P00352 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 2/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 3/20 0.43
THRB P10828 1/20 0.41
MAPK1 P28482 1/20 0.41
ABCB1 P08183 1/20 0.41
ABCC1 P33527 1/20 0.41

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
Hydrochloric Acid SCHEMBL4250477 0.99 DPP4 (0.50) DPP4DPP8RAB9ASMN1; SMN2KMT2A
SCHEMBL3150374 0.91 DPP4 (0.52) DPP4DPP8RAB9ASMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL4245600 0.89 DPP4 (0.52) DPP4DPP8RAB9ASMN1; SMN2KMT2A
SCHEMBL3155256 0.81 KMT2A (0.47) DPP4DPP8RAB9ASMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL4243022 0.81 KMT2A (0.47) RAB9ASMN1; SMN2KMT2AALDH1A1NPSR1
SCHEMBL3153213 0.80 KMT2A (0.52) DPP4DPP8RAB9ASMN1; SMN2KMT2A
SCHEMBL3155041 0.80 DPP4 (0.49) DPP4DPP8RAB9ASMN1; SMN2KMT2A
SCHEMBL3144330 0.80 DPP4 (0.49) DPP4DPP8RAB9ASMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL4248376 0.79 DPP4 (0.48) DPP4DPP8RAB9ASMN1; SMN2KMT2A
SCHEMBL3149555 0.78 KMT2A (0.48) DPP4DPP8RAB9ASMN1; SMN2KMT2A

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-2036892-B1 1,2,4,5-tetrahydro-3H-benzazepine derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2010-03-10 EP disclosed
EP-2036892-A1 1,2,4,5-tetrahydro-3H-benzazepine derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2009-03-18 EP disclosed