SCHEMBL7366193

SCHEMBL7366193

CC(C)(C)OC(=O)N(CCCC1CCN(C(=O)OCc2ccccc2)CC1)[C@H](CO)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
CYP2C19 P33261 1/20 0.44
GRIN2B Q13224 8/20 0.43
HTT P42858 1/20 0.43
YAP1 P46937 2/20 0.43
CYP2D6 P10635 4/20 0.43
CYP2C9 P11712 4/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ITGB3 P05106 1/20 0.42
ITGA2B P08514 1/20 0.42
CYP3A4 P08684 3/20 0.41
STS P08842 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 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
SCHEMBL27140255 0.84 SMN1; SMN2 (0.52) FAAHSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL6651386 0.80 SMN1; SMN2 (0.54) FAAHSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL27141260 0.79 JAK2 (0.51) FAAHSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL21997461 0.76 KDM4E (0.52) SMN1; SMN2NPC1RAB9ACYP2C19HTT
SCHEMBL27035707 0.76 SMN1; SMN2 (0.54) FAAHSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL29201715 0.76 SMN1; SMN2 (0.54) FAAHSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL7107231 0.76 SMN1; SMN2 (0.65) FAAHSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL16095464 0.75 SMN1; SMN2 (0.58) FAAHSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL6543257 0.75 YAP1 (0.53) FAAHSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL1495946 0.75 SMN1; SMN2 (0.53) FAAHSMN1; SMN2NPC1RAB9ACYP2C19

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
EP-0292923-A2 Piperidine compounds and pharmaceutical uses thereof Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-11-30 EP disclosed