SCHEMBL8935232

SCHEMBL8935232

CN(Cc1ccc(OCCc2ccccc2)cc1)C(=O)C(N)CO

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.51
LTA4H P09960 1/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LTB4R Q15722 3/20 0.46
LTB4R2 Q9NPC1 3/20 0.46
PPARG P37231 2/20 0.46
MAPK1 P28482 1/20 0.46
HPGD P15428 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 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
SCHEMBL8935310 0.79 MAOB (0.55)
SCHEMBL8935286 0.79 MAOB (0.54) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL8935296 0.78 ALOX5 (0.60) FFAR1
SCHEMBL8935251 0.78 MAOB (0.58)
SCHEMBL8935348 0.77 MAOB (0.58) FFAR1MEN1KMT2A
SCHEMBL1337896 0.76 HPGD (0.56) NPC1RAB9ASMN1; SMN2HPGDMEN1
Hydrochloric Acid SCHEMBL20569691 0.76 LTA4H (0.47) LTA4HSMN1; SMN2
SCHEMBL8935376 0.76 MAOB (0.60) FFAR1
SCHEMBL14971101 0.75 HPGD (0.55) NPC1RAB9ASMN1; SMN2MAPK1HPGD
SCHEMBL12354491 0.75 HPGD (0.55) NPC1RAB9ASMN1; SMN2MAPK1HPGD

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