SCHEMBL6672640

SCHEMBL6672640

CC1(Cc2ccccc2)CCC1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.50
MAOB P27338 7/20 0.50
OPRL1 P41146 3/20 0.42
OPRM1 P35372 2/20 0.42
OPRK1 P41145 1/20 0.42
ELANE P08246 1/20 0.40
TP53 P04637 1/20 0.39
KDM1A O60341 4/20 0.37
GAA P10253 1/20 0.36
CALM1 P0DP23 1/20 0.36

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
SCHEMBL5639001 0.95 MAOA (0.50) MAOAMAOBOPRL1OPRM1OPRK1
SCHEMBL6388482 0.93 MAOA (0.48) MAOAMAOBOPRL1OPRM1OPRK1
SCHEMBL27488335 0.93 MAOA (0.48) MAOAMAOBOPRL1OPRM1OPRK1
SCHEMBL2374703 0.91 MAOA (0.54) MAOAMAOBOPRL1OPRM1OPRK1
SCHEMBL11365074 0.84 MAOA (0.48) MAOAMAOBOPRL1OPRM1OPRK1
SCHEMBL28259694 0.83 OPRL1 (0.41) MAOAMAOBOPRL1OPRM1OPRK1
SCHEMBL28161193 0.81 MAOA (0.48) MAOAMAOBOPRL1OPRM1OPRK1
SCHEMBL13757097 0.81 TSHR (0.46) MAOAMAOBOPRL1OPRM1OPRK1
SCHEMBL11474711 0.79 MEN1 (0.47) MAOAMAOBOPRL1OPRM1OPRK1
SCHEMBL23542798 0.78 ESR1 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5330999-A Diabetes, obesity ADIR ET COMPAGNIE (FR) 1994-07-19 US claimed
CN-109313397-A The manufacturing method of laminated body, the manufacturing method of semiconductor element and laminated body 富士胶片株式会社 2019-02-05 CN disclosed
EP-1465862-A1 CYCLOALKYL KETOAMIDES DERIVATIVES USEFUL AS CATHEPSIN K INHIBITORS SmithKline Beecham Corporation (US) 2004-10-13 EP disclosed
WO-2003062192-A1 CYCLOALKYL KETOAMIDES DERIVATIVES USEFUL AS CATHEPSIN K INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-07-31 WO disclosed