SCHEMBL8675186

SCHEMBL8675186

CC(C)C1CCC(C)(c2ccccc2)C(c2ccccc2)C1.N=C=O.N=C=O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 3/20 0.35
KDM1A O60341 11/20 0.34
MAOB P27338 11/20 0.34
MAOA P21397 10/20 0.34
RORC P51449 3/20 0.33

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
SCHEMBL337274 0.92 KDM1A (0.40) OPRL1KDM1AMAOBMAOARORC
SCHEMBL4333830 0.75 ESR2 (0.42)
SCHEMBL24322076 0.73 SLC6A4 (0.38) OPRL1KDM1AMAOBMAOA
SCHEMBL5244042 0.73 OPRL1 (0.39) OPRL1KDM1AMAOBMAOA
SCHEMBL27488523 0.72 OPRL1 (0.35) OPRL1
SCHEMBL27630906 0.72 OPRL1 (0.35) OPRL1
SCHEMBL27772756 0.72 OPRL1 (0.35) OPRL1
SCHEMBL4753778 0.72 OPRL1 (0.35) OPRL1KDM1AMAOBMAOA
SCHEMBL17847283 0.71 DPP4 (0.37) OPRL1KDM1AMAOBMAOA
SCHEMBL8196759 0.70 GAA (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5374667-A Process for the preparation of fluorochlorohydrocarbon-free, low-density polyurethan soft foams and soft elastic polyurethan molding foams and polyisocyanate mixtures modified with urethan groups on diphenylmethane-diisocyanate base BASF AKTIENGESELLSCHAFT (DE) 1994-12-20 US claimed
EP-0386777-A2 PS plate for use in making lithographic printing plate requiring no dampening water Fuji Photo Film Co., Ltd. (JP) 1990-09-12 EP claimed
US-4458007-A PRINTING PLATES, PHOTORESISTS HOECHST AKTIENGESELLSCHAFT (DE) 1984-07-03 US claimed
CN-101402716-B Mixed prepolymer of solidifying agent methyl diphenylene diisocyanate and 1,6-hexamethylene diisocyanate and its preparation method JIANMING ZHOU 2012-01-11 CN disclosed
CN-101402716-A Mixed prepolymer of solidifying agent methyl diphenylene diisocyanate and 1,6-hexamethylene diisocyanate JIANMING ZHOU (CN) 2009-04-08 CN disclosed
US-5795633-A POLYURETHANES, TUBULAR BALLOON FORM NIPPON ZEON CO., LTD. (JP) 1998-08-18 US disclosed
EP-0276927-A2 Storage stable isocyanate prepolymers POLYOL INTERNATIONAL B.V. (NL) 1988-08-03 EP disclosed