SCHEMBL6570980

SCHEMBL6570980

[CH](CCc1ccccc1)CCC1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.45
EPHX2 P34913 1/20 0.44
OPRM1 P35372 3/20 0.44
OPRD1 P41143 3/20 0.44
OPRK1 P41145 3/20 0.44
SLC18A3 Q16572 1/20 0.41
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
SLC18A2 Q05940 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 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
SCHEMBL7393632 0.84 EPHX2 (0.45) SIGMAR1EPHX2OPRM1OPRD1OPRK1
SCHEMBL287559 0.82 SIGMAR1 (0.49) SIGMAR1EPHX2OPRM1OPRD1OPRK1
SCHEMBL6567915 0.82 LMNA (0.47)
SCHEMBL60979 0.81 CTSS (0.54) SIGMAR1EPHX2OPRM1OPRD1OPRK1
SCHEMBL705394 0.79 CTSS (0.56) OPRM1OPRD1OPRK1CTSSCTSK
SCHEMBL2440428 0.78 SLC18A3 (0.60) SIGMAR1EPHX2OPRM1OPRD1OPRK1
SCHEMBL7419921 0.78 SLC18A3 (0.60) SIGMAR1EPHX2OPRM1OPRD1OPRK1
SCHEMBL9133642 0.78 SLC18A3 (0.60) SIGMAR1EPHX2OPRM1OPRD1OPRK1
SCHEMBL6877800 0.77 CYP1A2 (0.46) SIGMAR1
SCHEMBL205556 0.77 ALDH1A1 (0.52) SIGMAR1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1404325-A2 METHOD FOR TREATING NERVE INJURY CAUSED BY SURGERY GUILFORD PHARMACEUTICALS INC. (US) 2004-04-07 EP disclosed
WO-2002096420-A2 METHOD FOR TREATING NERVE INJURY CAUSED BY SURGERY GUILFORD PHARMACEUTICALS INC. (US) 2002-12-05 WO disclosed
EP-1127049-A1 BRIDGED HETEROCYCLIC DERIVATIVES GPI NIL Holdings, Inc. (US) 2001-08-29 EP disclosed
EP-1011650-A1 METHOD FOR PREVENTING AND TREATING HEARING LOSS USING SENSORINEUROTROPHIC COMPOUNDS Amgen Inc., (US) 2000-06-28 EP disclosed
WO-2000016603-A2 BRIDGED HETEROCYCLIC DERIVATIVES GPI NIL HOLDINGS, INC. (US) 2000-03-30 WO disclosed
WO-1999014998-A2 METHOD FOR PREVENTING AND TREATING HEARING LOSS USING SENSORINEUROTROPHIC COMPOUNDS AMGEN INC. (US) 1999-04-01 WO disclosed