SCHEMBL8795071

SCHEMBL8795071

CS(=O)(=O)Nc1ccc(OCCCNC(=O)c2ccc(Br)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.56
RAB9A P51151 4/20 0.56
ALDH1A1 P00352 3/20 0.56
HPGD P15428 1/20 0.56
ADRB2 P07550 2/20 0.54
ADRB1 P08588 2/20 0.54
ADRB3 P13945 2/20 0.54
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.52
GRIN1 Q05586 1/20 0.50
GRIN2B Q13224 1/20 0.50
EPHX2 P34913 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
KMT2A Q03164 1/20 0.49
HSP90AA1 P07900 1/20 0.49
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL8488376 0.88 NPC1 (0.62) NPC1RAB9AALDH1A1HPGDADRB2
SCHEMBL16556594 0.78 KDM4E (0.63) ALDH1A1HPGDSMN1; SMN2EPHX2NR1H4
SCHEMBL10495144 0.77 NPC1 (0.65) NPC1RAB9AALDH1A1HPGDMAPT
SCHEMBL10495115 0.77 NPC1 (0.64) NPC1RAB9AALDH1A1HPGDMAPT
SCHEMBL22859084 0.76 ALDH1A1 (0.83) NPC1RAB9AALDH1A1HPGDMAPT
SCHEMBL3555970 0.75 NPC1 (0.61) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL9733253 0.75 NPC1 (0.69) NPC1RAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL13508331 0.75 SMN1; SMN2 (0.66) ALDH1A1SMN1; SMN2EPHX2NR1H4KMT2A
SCHEMBL748841 0.74 SMN1; SMN2 (0.64) ALDH1A1HPGDSMN1; SMN2EPHX2NR1H4
SCHEMBL9389817 0.73 NPC1 (0.67) NPC1RAB9AALDH1A1HPGDADRB2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792873-A1 N-(Phenoxyalkyl) carboxamides and their use as antiarrhythmic agents American Cyanamid Company (US) 1997-09-03 EP claimed
EP-0760811-A1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H 3? (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-03-12 EP claimed
EP-0792873-A1 N-(Phenoxyalkyl) carboxamides and their use as antiarrhythmic agents American Cyanamid Company (US) 1997-09-03 EP disclosed