SCHEMBL202072

SCHEMBL202072

CCCCCCCCCCCCCCCCCCc1cc(C(C)C)c(O)c(C(C)C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.58
GABRA1 P14867 1/20 0.57
GABRB1 P18505 1/20 0.57
GABRA5 P31644 1/20 0.57
GABRA3 P34903 1/20 0.57
GABRA2 P47869 1/20 0.57
GABRB2 P47870 1/20 0.57
GABRA4 P48169 1/20 0.57
GABRA6 Q16445 1/20 0.57
CYP3A4 P08684 2/20 0.55
GSR P00390 1/20 0.50
ESR1 P03372 2/20 0.48
ADRA2A P08913 2/20 0.48
ADORA3 P0DMS8 2/20 0.48
TACR2 P21452 2/20 0.48
SLC6A2 P23975 2/20 0.48
SLC6A4 P31645 2/20 0.48
SLC6A3 Q01959 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48

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
SCHEMBL200322 1.00 PTGS2 (0.58) PTGS2GABRA1GABRB1GABRA5GABRA3
SCHEMBL200138 0.92 GABRA1 (0.60) PTGS2GABRA1GABRB1GABRA5GABRA3
SCHEMBL11799626 0.88 PTGS2 (0.50) PTGS2GABRA1GABRB1GABRA5GABRA3
SCHEMBL8677678 0.86 PTGS2 (0.47) PTGS2GABRA1GABRB1GABRA5GABRA3
SCHEMBL200922 0.86 PTGS2 (0.55) PTGS2GABRA1GABRB1GABRA5GABRA3
SCHEMBL202852 0.86 PTGS2 (0.55) PTGS2GABRA1GABRB1GABRA5GABRA3
SCHEMBL31276244 0.85 GABRA1 (0.50) PTGS2GABRA1GABRB1GABRA5GABRA3
SCHEMBL7248031 0.85 PTGS2 (0.46) PTGS2GABRA1GABRB1GABRA5GABRA3
SCHEMBL11804313 0.84 PTGS2 (0.53) PTGS2GABRA1GABRB1GABRA5GABRA3
SCHEMBL11801309 0.84 PTGS2 (0.53) PTGS2GABRA1GABRB1GABRA5GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10230023-B2 Color converter BASF SE (DE) 2019-03-12 US disclosed
EP-2718395-B1 Novel illumination device comprising a colour converter BASF SE (DE) 2018-02-28 EP disclosed
US-20160284947-A1 NOVEL COLOR CONVERTER BASF SE (DE) 2016-09-29 US disclosed
US-9406848-B2 Color converter BASF SE (DE) 2016-08-02 US disclosed
EP-2307507-B1 NEW AZIDE SUBSTITUTED NAPHTHYLENE OR RYLENE IMIDE DERIVATIVES AND THEIR USE AS REAGENTS IN CLICK-REACTIONS BASF SE (DE) 2016-04-20 EP disclosed
CN-101223172-B substituted Rylene derivatives BASF AG (DE) 2015-11-25 CN disclosed
EP-1917311-B1 Rylene based multiple chromophores BASF SE (DE) 2015-09-23 EP disclosed
US-8921558-B2 Azide substituted naphthylene or rylene imide derivatives and their use as reagents in click-reactions BASF SE (DE) 2014-12-30 US disclosed
US-8802852-B2 Azide substituted naphthylene or rylene imide derivatives and their use as reagents in click-reactions BASF SE (DE) 2014-08-12 US disclosed
EP-2718395-A1 NOVEL COLOR CONVERTER BASF SE (DE) 2014-04-16 EP disclosed
CN-1052022-C Polymer composition and core-shell elastomer for use in the composition MITSUI PETROCHEMICAL IND (JP) 2000-05-03 CN disclosed
CN-1215069-A Polymer composition and core-shell elastomer used therefor MITSUI CHEMICALS INC (JP) 1999-04-28 CN disclosed
US-5770655-A ACRYLATE MONOMER WITH MULTICYCLIC FUSED RING IN ESTER GROUP, OPTICAL FIBERS AND DISKS, CLARITY AND IMPACT STRENGTH, TETRACYCLODODECYL ACRYLATE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1998-06-23 US disclosed
EP-0671433-B1 Polymer composition and core-shell elastomer used therefor MITSUI CHEMICALS INC (JP) 1998-06-17 EP disclosed
EP-0579576-B1 2,4-Dialkyl-6-sec-alkylphenols CIBA GEIGY AG (CH) 1998-05-20 EP disclosed
US-5574100-A ALPHA-OLEFIN-CYCLIC OLEFIN COPOLYMER, BUTADIENE-STYRENE COPOLYMER CORE, ALICYCLIC ACRYLATE SHELL MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1996-11-12 US disclosed
CN-1111658-A Polymer composition and core-shell elastomer for use in the composition MITSUI PETROCHEMICAL IND (JP) 1995-11-15 CN disclosed
EP-0671433-A1 Polymer composition and core-shell elastomer used therefor MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1995-09-13 EP disclosed
US-5356976-A Stabilize organic materials against degradation by oxidation, heat or actinic light CIBA-GEIGY CORPORATION (US) 1994-10-18 US disclosed
EP-0579576-A1 2,4-Dialkyl-6-sec-alkylphenols CIBA-GEIGY AG (CH) 1994-01-19 EP disclosed