SCHEMBL9350520

SCHEMBL9350520

CC(=O)NCC1(Cc2ccccc2)CCC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.50
OPRL1 P41146 3/20 0.50
NPFFR1 Q9GZQ6 6/20 0.49
NPFFR2 Q9Y5X5 6/20 0.49
OPRK1 P41145 1/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
GAA P10253 1/20 0.41
CCR5 P51681 1/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
PTPN1 P18031 1/20 0.41
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40

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
SCHEMBL9146667 0.97 OPRM1 (0.50) OPRM1OPRL1NPFFR1NPFFR2OPRK1
SCHEMBL9350637 0.87 ALDH1A1 (0.41) OPRM1OPRL1NPFFR1NPFFR2ALDH1A1
SCHEMBL9143220 0.85 KMT2A (0.43) OPRM1OPRL1NPFFR1NPFFR2RAB9A
SCHEMBL9350621 0.84 ALDH1A1 (0.41) OPRM1OPRL1NPFFR1NPFFR2SMN1; SMN2
SCHEMBL14279001 0.83 CYP3A4 (0.41) OPRM1OPRL1NPFFR1NPFFR2NPC1
SCHEMBL9140934 0.82 CYP4F2 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL9141193 0.82 KMT2A (0.43) OPRM1OPRL1NPFFR1NPFFR2RAB9A
SCHEMBL9140301 0.80 CYP4F2 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL2861616 0.79 LMNA (0.58) OPRM1NPFFR1NPFFR2OPRK1NPC1
SCHEMBL2877082 0.79 NPFFR1 (0.56) NPFFR1NPFFR2OPRK1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0472449-B1 Substituted sulfonamides, processes for their preparation and medicines containing them LIPHA (FR) 1994-09-14 EP disclosed
EP-0472449-A2 Substituted sulfonamides, processes for their preparation and medicines containing them LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1992-02-26 EP disclosed