SCHEMBL8698664

SCHEMBL8698664

CCCn1cc(C(=O)O)c(NC(=O)NC2CCCCC2)n1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 3/20 0.43
KMT2A Q03164 2/20 0.43
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
EPHX1 P07099 5/20 0.42
EPHX2 P34913 2/20 0.42
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL8696537 0.91 RAB9A (0.55) RAB9ASMN1; SMN2NPC1KMT2AEPHX1
SCHEMBL8696400 0.89 ALDH1A1 (0.45) RAB9ASMN1; SMN2NPC1KMT2ACNR1
SCHEMBL8696502 0.87 RAB9A (0.44) RAB9ASMN1; SMN2NPC1KMT2ACNR1
SCHEMBL8695922 0.82 ALDH1A1 (0.43) KMT2ACNR1CNR2KDM4EALDH1A1
SCHEMBL8693738 0.82 HPGD (0.52) RAB9ASMN1; SMN2NPC1KMT2ACNR1
SCHEMBL8698684 0.81 CNR2 (0.43) RAB9ASMN1; SMN2NPC1KMT2ACNR1
SCHEMBL8693781 0.79 RAB9A (0.47) RAB9ASMN1; SMN2NPC1KMT2AKDM4E
SCHEMBL8693769 0.78 HCAR2 (0.40) RAB9ASMN1; SMN2NPC1KMT2AEPHX1
SCHEMBL8692495 0.77 RAB9A (0.54) RAB9ASMN1; SMN2NPC1KMT2AEPHX2
SCHEMBL8696385 0.76 MAPT (0.52) RAB9ANPC1KMT2ACNR1CNR2

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