SCHEMBL8696537

SCHEMBL8696537

CCn1cc(C(=O)O)c(NC(=O)NC2CCCCC2)n1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
NPC1 O15118 4/20 0.45
KMT2A Q03164 2/20 0.44
EPHX1 P07099 7/20 0.44
EPHX2 P34913 1/20 0.44
BRAF P15056 1/20 0.42
MEN1 O00255 1/20 0.42
HTT P42858 1/20 0.42
MAPK13 O15264 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
MAPK14 Q16539 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
SCHEMBL8698664 0.91 RAB9A (0.45) RAB9ASMN1; SMN2NPC1KMT2AEPHX1
SCHEMBL8693781 0.88 RAB9A (0.47) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL8692495 0.86 RAB9A (0.54) RAB9ASMN1; SMN2NPC1KMT2AEPHX2
SCHEMBL8693738 0.84 HPGD (0.52) RAB9ASMN1; SMN2NPC1KMT2AEPHX1
SCHEMBL8696400 0.79 ALDH1A1 (0.45) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL8695922 0.78 ALDH1A1 (0.43) KMT2AMEN1
SCHEMBL8696502 0.78 RAB9A (0.44) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL8698684 0.76 CNR2 (0.43) RAB9ASMN1; SMN2NPC1KMT2AEPHX1
SCHEMBL8696204 0.76 FAAH (0.48) RAB9ASMN1; SMN2NPC1KMT2AEPHX1
SCHEMBL8696424 0.76 SMN1; SMN2 (0.40) RAB9ASMN1; SMN2NPC1KMT2AEPHX1

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
US-5849779-A Pyrazole derivatives and their pharmaceutical use JAPAN ENERGY CORPORATION (JP) 1998-12-15 US disclosed
EP-0810217-A1 Pyrazole derivatives and their pharmaceutical use as smooth muscle cell growth inhibitors JAPAN ENERGY CORPORATION (JP) 1997-12-03 EP disclosed