SCHEMBL6790349

SCHEMBL6790349

Cc1ccc(CN(C(=O)NCc2ccccc2)C2(C)CCNCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.52
GAA P10253 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
TP53 P04637 1/20 0.45
HPGD P15428 1/20 0.45
OPRM1 P35372 1/20 0.44
OPRL1 P41146 1/20 0.44
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPK14 Q16539 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
PKM P14618 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 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
SCHEMBL19470000 0.80 OPRM1 (0.44) MEN1KMT2ANPC1RAB9AOPRM1
SCHEMBL10322397 0.76 HTR2A (0.58) SMN1; SMN2GAAHPGDOPRM1CYP3A4
SCHEMBL340564 0.76 HTR2A (0.58) SMN1; SMN2GAAHPGDOPRM1CYP3A4
SCHEMBL29221795 0.75 SMN1; SMN2 (0.66) SMN1; SMN2GAAMEN1KMT2ANPC1
SCHEMBL21077981 0.73 SMN1; SMN2 (0.51) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL4201868 0.73 MEN1 (0.50) SMN1; SMN2MEN1KMT2AOPRM1HTT
SCHEMBL6017363 0.73 SMN1; SMN2 (0.56) SMN1; SMN2GAAMEN1KMT2ANPC1
SCHEMBL30463552 0.72 OPRM1 (0.41) SMN1; SMN2GAAMEN1KMT2ANPC1
SCHEMBL5592055 0.72 NPSR1 (0.41) NPC1RAB9AOPRM1
SCHEMBL5695520 0.71 OPRM1 (0.49) SMN1; SMN2MEN1KMT2AHPGDOPRM1

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
US-6815458-B2 NERVOUS SYSTEM DISORDERS ACADIA PHARMACEUTICALS, INC 2004-11-09 US claimed