SCHEMBL8935264

SCHEMBL8935264

CC(N)C(=O)NCc1ccc(OCc2cccs2)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.54
POLB P06746 3/20 0.54
NPC1 O15118 2/20 0.54
CARM1 Q86X55 4/20 0.52
PRMT6 Q96LA8 4/20 0.52
LTA4H P09960 1/20 0.47
HPGD P15428 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
GAA P10253 1/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL7397015 0.81 SCN9A (0.61) RAB9APOLBNPC1
SCHEMBL4816702 0.81 SCN9A (0.61) RAB9APOLBNPC1
SCHEMBL8935256 0.81 POLB (0.59) RAB9APOLBNPC1HPGDSMN1; SMN2
SCHEMBL8935386 0.80 CARM1 (0.51) CARM1PRMT6LTA4H
SCHEMBL8935341 0.79 LTA4H (0.53) RAB9APOLBNPC1CARM1PRMT6
SCHEMBL8935415 0.76 CARM1 (0.58) RAB9ANPC1CARM1PRMT6LTA4H
SCHEMBL8935290 0.76 CARM1 (0.60) CARM1PRMT6LTA4HSMN1; SMN2GAA
SCHEMBL8935452 0.76 SCN9A (0.68) CARM1PRMT6LTA4H
SCHEMBL8935244 0.75 MAOB (0.69)
SCHEMBL14323980 0.75 MAOB (0.69)

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-5502079-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS FARMITALIA CARLO ERBA S.R.L. (IT) 1996-03-26 US disclosed