SCHEMBL862127

SCHEMBL862127

C1=C\CCc2ccccc2CC/1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
HTR2C P28335 1/20 0.48
MAOB P27338 3/20 0.42
CYP2A6 P11509 1/20 0.42
PNMT P11086 1/20 0.42
CD44 P16070 1/20 0.42
MAOA P21397 2/20 0.40
DRD2 P14416 1/20 0.40
DRD1 P21728 1/20 0.40
DRD4 P21917 1/20 0.40
DRD5 P21918 1/20 0.40
DRD3 P35462 1/20 0.40
PLAU P00749 1/20 0.39
CES1 P23141 1/20 0.38
GRIN2B Q13224 1/20 0.37
CYP1A2 P05177 1/20 0.36
ORAI1 Q96D31 1/20 0.36
ORAI2 Q96SN7 1/20 0.36
ORAI3 Q9BRQ5 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
SCHEMBL862128 1.00 TSHR (0.56) TSHRHTR2CMAOBCYP2A6PNMT
SCHEMBL594989 0.89 TSHR (0.46) TSHRHTR2CMAOBCYP2A6PNMT
SCHEMBL30492078 0.89 TSHR (0.60) TSHRHTR2CMAOBCYP2A6PNMT
SCHEMBL30877931 0.87 TSHR (0.65) TSHRHTR2CMAOBCYP2A6PNMT
SCHEMBL30877942 0.84 TSHR (0.62) TSHRHTR2CMAOBCYP2A6PNMT
SCHEMBL4166748 0.80 TSHR (0.56) TSHRHTR2CMAOBCYP2A6PNMT
SCHEMBL30405051 0.79 TSHR (0.72) TSHRHTR2CMAOBCYP2A6PNMT
Cyclohexene SCHEMBL8632745 0.79 TSHR (0.63) TSHRHTR2CMAOBCYP2A6PNMT
SCHEMBL29351986 0.78
SCHEMBL33555 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1655319-B1 POLYMERIZABLE COMPOSITION AND FORMED BODY THEREOF ZEON CORP (JP) 2012-03-28 EP disclosed
US-20100124615-A1 Process for Producing Crosslinkable Resin Formed Product ZEON CORPORATION (JP) 2010-05-20 US disclosed
US-20090305018-A1 Crosslinkable-Resin Formed Product, Crosslinked-Resin Formed Product, and Crosslinked Resin-Metal Clad Laminate ZEON CORPORATION (JP) 2009-12-10 US disclosed
US-7579404-B2 Polymerizable composition and molded product thereof ZEON CORPORATION (JP) 2009-08-25 US disclosed
EP-2017304-A1 PROCESS FOR PRODUCING CROSSLINKABLE RESIN MOLDING ZEON CORPORATION (JP) 2009-01-21 EP disclosed
EP-1990364-A1 MOLDED CROSSLINKABLE-RESIN OBJECT, MOLDED CROSSLINKED-RESIN OBJECT, AND CROSSLINKED-RESIN/METAL LAMINATE ZEON CORPORATION (JP) 2008-11-12 EP disclosed
US-20060293444-A1 Polymerizable composition and molded product thereof ZEON CORPORATION (JP) 2006-12-28 US disclosed
EP-1655319-A1 POLYMERIZABLE COMPOSITION AND FORMED BODY THEREOF Zeon Corporation (JP) 2006-05-10 EP disclosed