SCHEMBL5574050

SCHEMBL5574050

C=C(C)c1cccc(C(C)C)c1C(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.45
GABRG2 P18507 2/20 0.45
GABRB3 P28472 2/20 0.45
GABRB2 P47870 2/20 0.45
LMNA P02545 2/20 0.45
FAAH O00519 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
GABRB1 P18505 1/20 0.45
PTGS1 P23219 1/20 0.45
SLC6A2 P23975 1/20 0.45
HTR2C P28335 1/20 0.45
GABRA5 P31644 1/20 0.45
GABRA3 P34903 1/20 0.45
HTR2B P41595 1/20 0.45
GABRA2 P47869 1/20 0.45

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
SCHEMBL22325667 0.83 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL1362730 0.83 GABRA1 (0.50) GABRA1GABRG2GABRB3GABRB2LMNA
Hydrogen Peroxide SCHEMBL9619640 0.81 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL5145459 0.80 GABRA1 (0.45) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL11443931 0.80 GABRA1 (0.39) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL4772088 0.80 GABRA1 (0.61) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL557360 0.80 GABRA1 (0.45) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL25675270 0.78 CES2 (0.35) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL23590451 0.78 GABRA1 (0.43) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL6203469 0.78 GABRA1 (0.43) GABRA1GABRG2GABRB3GABRB2LMNA

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1243702-C Method of dehydrogenating triisopropylbenzene and diisopropylbenzene MITSUI CHEMICALS INC (JP) 2006-03-01 CN claimed
US-6743959-B1 CHROMIUM FREE CATALYTIC SYNTHESIS OF UNSATURATED CHEMICAL INTERMEDIATES MITSUI CHEMICALS, INC. (JP) 2004-06-01 US claimed
CN-1382112-A Process for the dehydrogenation of triisopropylbenzene and diisopropylbenzene MITSUI CHEMICALS INC (JP) 2002-11-27 CN claimed
EP-1219582-A1 METHOD OF DEHYDROGENATING TRIISOPROPYLBENZENE AND DIISOPROPYLBENZENE Mitsui Chemicals, Inc. (JP) 2002-07-03 EP claimed
EP-0250090-B1 STORAGE STABLE LATENTLY CURABLE ACRYLIC FORMULATIONS EMPLOYING POLYMERIC HYDROPEROXIDES LOCTITE CORPORATION (US) 1992-01-29 EP claimed
CN-110072933-B Tire comprising a polyindane resin and use thereof 伊士曼化工公司 2022-04-05 CN disclosed
CN-110072962-B Adhesive comprising a polyindane resin 伊士曼化工公司 2021-10-19 CN disclosed
EP-3555188-B1 TIRES COMPRISING POLYINDANE RESINS AND USES THEREOF EASTMAN CHEM CO (US) 2021-07-14 EP disclosed
US-11008444-B2 Tires comprising polyindane resins and uses thereof EASTMAN CHEMICAL COMPANY (US) 2021-05-18 US disclosed
US-10851270-B2 Adhesives comprising polyindane resins EASTMAN CHEMICAL COMPANY (US) 2020-12-01 US disclosed
EP-3555221-A1 ADHESIVES COMPRISING POLYINADANE RESINS Eastman Chemical Company (US) 2019-10-23 EP disclosed
EP-3555188-A1 TIRES COMPRISING POLYINDANE RESINS AND USES THEREOF Eastman Chemical Company (US) 2019-10-23 EP disclosed
EP-1219582-A4 METHOD OF DEHYDROGENATING TRIISOPROPYLBENZENE AND DIISOPROPYLBENZENE MITSUI CHEMICALS INC (JP) 2004-09-08 EP disclosed
US-6743959-B1 CHROMIUM FREE CATALYTIC SYNTHESIS OF UNSATURATED CHEMICAL INTERMEDIATES MITSUI CHEMICALS, INC. (JP) 2004-06-01 US disclosed
US-6743959-B1 CHROMIUM FREE CATALYTIC SYNTHESIS OF UNSATURATED CHEMICAL INTERMEDIATES MITSUI CHEMICALS, INC. (JP) 2004-06-01 US disclosed
CN-1382112-A Process for the dehydrogenation of triisopropylbenzene and diisopropylbenzene MITSUI CHEMICALS INC (JP) 2002-11-27 CN disclosed
CN-1382112-A Process for the dehydrogenation of triisopropylbenzene and diisopropylbenzene MITSUI CHEMICALS INC (JP) 2002-11-27 CN disclosed
EP-1219582-A1 METHOD OF DEHYDROGENATING TRIISOPROPYLBENZENE AND DIISOPROPYLBENZENE Mitsui Chemicals, Inc. (JP) 2002-07-03 EP disclosed
EP-1219582-A1 METHOD OF DEHYDROGENATING TRIISOPROPYLBENZENE AND DIISOPROPYLBENZENE Mitsui Chemicals, Inc. (JP) 2002-07-03 EP disclosed
WO-2001016062-A1 METHOD OF DEHYDROGENATING TRIISOPROPYLBENZENE AND DIISOPROPYLBENZENE MITSUI CHEMICALS, INCORPORATED (JP) 2001-03-08 WO disclosed