SCHEMBL7756938

SCHEMBL7756938

c1ccc(CCC2CCC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.58
OPRD1 P41143 1/20 0.58
OPRK1 P41145 1/20 0.58
SLC18A2 Q05940 1/20 0.58
CTSS P25774 1/20 0.56
CTSK P43235 1/20 0.56
MAOA P21397 1/20 0.54
MAOB P27338 1/20 0.54

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
SCHEMBL705394 0.95 CTSS (0.56) OPRM1OPRD1OPRK1SLC18A2CTSS
SCHEMBL60979 0.93 CTSS (0.54) OPRM1OPRD1OPRK1SLC18A2CTSS
SCHEMBL1609623 0.91 MAOA (0.58) SLC18A2CTSSCTSKMAOAMAOB
Ammonia Solution, Strong SCHEMBL20702116 0.85 SLC18A3 (0.56) OPRM1OPRD1OPRK1SLC18A2
SCHEMBL6399379 0.85 CTSS (0.48) OPRM1OPRD1OPRK1SLC18A2CTSS
SCHEMBL16191113 0.83 SLC18A2 (0.51) OPRM1OPRD1OPRK1SLC18A2CTSS
SCHEMBL6399518 0.83 CTSS (0.47) OPRM1OPRD1OPRK1SLC18A2CTSS
SCHEMBL16191193 0.83 SLC18A2 (0.51) OPRM1OPRD1OPRK1SLC18A2CTSS
SCHEMBL7103234 0.83 SLC18A3 (0.62) OPRM1OPRD1OPRK1
SCHEMBL3172080 0.82 MAOA (0.47) SLC18A2CTSSCTSKMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108137508-A 5-HT2CReceptor agonists and compositions and methods of use 艾尼纳制药公司 2018-06-08 CN disclosed
EP-1090908-A2 Cyclobutane derivatives as inhibitors of protein farnesyltransferase ABBOTT LABORATORIES (US) 2001-04-11 EP disclosed
WO-2000058346-A1 N-SULFONYL-DIPEPTIDE DERIVATIVES, PRODUCTION AND USE THEREOF IN THERAPY SANOFI-SYNTHELABO (FR) 2000-10-05 WO disclosed
EP-0677039-B1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE ABBOTT LAB (US) 1999-03-10 EP disclosed
US-5831115-A CYCLOBUTANECARBOXAMIDES ABBOTT LABORATORIES (US) 1998-11-03 US disclosed
US-5783593-A FUNGICIDE; ANTICHOLESTEROL AGENT ABBOTT LABORATORIES (US) 1998-07-21 US disclosed
EP-0821665-A1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHASE AND PROTEIN FARNESYLTRANSFERASE Abbott Laboratories (US) 1998-02-04 EP disclosed
WO-1996034851-A1 BENZENE, PYRIDINE, NAPHTALENE OR BENZOPHENONE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE ABBOTT LABORATORIES (US) 1996-11-07 WO disclosed
WO-1996034850-A1 CYCLOBUTANE DERIVATIVES AND THEIR USE AS INHIBITORS OF PROTEIN FARNESYLTRANSFERASE ABBOTT LABORATORIES (US) 1996-11-07 WO disclosed
WO-1996033159-A1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHASE AND PROTEIN FARNESYLTRANSFERASE ABBOTT LABORATORIES (US) 1996-10-24 WO disclosed
EP-0677039-A1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE Abbott Laboratories (US) 1995-10-18 EP disclosed
WO-1995012572-A1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE ABBOTT LABORATORIES (US) 1995-05-11 WO disclosed