SCHEMBL2136867

SCHEMBL2136867

CCC=Cc1ccc2ccccc2c1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RELA Q04206 1/20 0.59
▸ NQO2 P16083 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ GLA P06280 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ PTGS1 P23219 1/20 0.52
▸ CHRNB4 P30926 1/20 0.48
▸ CHRNA3 P32297 1/20 0.48
▸ CHRNA7 P36544 1/20 0.48
▸ HDAC1 Q13547 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ GRIK1 P39086 1/20 0.46
▸ GRIK2 Q13002 1/20 0.46
▸ GRIK3 Q13003 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2A6 P11509 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
SCHEMBL5411288 0.94 RELA (0.52) RELANQO2ALDH1A1GLAMAPT
SCHEMBL29084177 0.82 HDAC1 (0.56) RELANQO2ALDH1A1GLAMAPT
SCHEMBL29084182 0.82 HDAC1 (0.56) RELANQO2ALDH1A1GLAMAPT
SCHEMBL140015 0.81 RELA (0.54) RELANQO2ALDH1A1GLAMAPT
SCHEMBL5552166 0.80 RELA (0.86) RELANQO2ALDH1A1GLAMAPT
SCHEMBL5050698 0.80 RELA (0.86) RELANQO2ALDH1A1GLAMAPT
SCHEMBL29842519 0.80 RELA (0.86) RELANQO2ALDH1A1GLAMAPT
SCHEMBL5050695 0.80 RELA (0.86) RELANQO2ALDH1A1GLAMAPT
SCHEMBL5552162 0.80 RELA (0.86) RELANQO2ALDH1A1GLAMAPT
SCHEMBL3321000 0.80 RELA (0.59) RELANQO2ALDH1A1GLAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220396654-A1 Modified Diene Copolymers and Their Use DYNASOL ELASTÓMEROS, S.A. DE C.V. (MX) 2022-12-15 — — US claimed
EP-4055072-A2 MODIFIED DIENE COPOLYMERS AND THEIR USE Dynasol Elastómeros, S.A.de C.V. (MX) 2022-09-14 — — EP claimed
CN-114929766-A Modified diene copolymer and use thereof 戴纳索尔伊莱斯托米罗斯公司 2022-08-19 — — CN claimed
CN-108559288-B Tapered triblock copolymers 戴纳索尔伊莱斯托米罗斯公司 2020-10-27 — — CN claimed
CN-108641268-B Tapered triblock copolymers 戴纳索尔伊莱斯托米罗斯公司 2020-08-04 — — CN claimed
CN-108587535-B Tapered triblock copolymers 戴纳索尔伊莱斯托米罗斯公司 2020-05-05 — — CN claimed
EP-2668214-A2 TAPERED TRIBLOCK COPOLYMERS Dynasol Elastómeros, S.A.de C.V. (MX) 2013-12-04 — — EP claimed
WO-2012101516-A2 TAPERED TRIBLOCK COPOLYMERS DYNASOL ELASTÓMEROS, S.A.DE C.V. (MX) 2012-08-02 — — WO claimed
US-12460082-B2 Counter tapered thermoplastic elastomers DYNASOL ELASTÓMEROS, S.A. DE C.V. (MX) 2025-11-04 — — US disclosed
EP-4540321-A1 COUNTER TAPERED THERMOPLASTIC ELASTOMERS Dynasol Elastómeros, S.A.de C.V. (MX) 2025-04-23 — — EP disclosed
CN-119731272-A Reverse tapered thermoplastic elastomer 戴纳索尔伊莱斯托米罗斯公司 2025-03-28 — — CN disclosed
US-20250011519-A1 Thermoplastic Elastomers of High Vinyl Block Copolymer Compositions DYNASOL ELASTÓMEROS, S.A. DE C.V. (MX) 2025-01-09 — — US disclosed
US-12173106-B2 Polar modifier systems for high vinyl block copolymerization DYNASOL ELASTÓMEROS, S.A. DE C.V. (MX) 2024-12-24 — — US disclosed
US-20240368386-A1 Dual Composition Block Copolymers DYNASOL ELASTÓMEROS, S.A. DE C.V. (MX) 2024-11-07 — — US disclosed
US-5219948-A Polymerizing alpha-olefin or conjugated diene in presence of titanium tetrachloride and electron pair donor UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1993-06-15 — — US disclosed
US-5218053-A Anionically polymerizing conjugated alkadienes or alkenyl aromatics and an unsaturated ester; hydrogenating; heating to cyclize SHELL OIL COMPANY (US) 1993-06-08 — — US disclosed
US-5206300-A Blends with engineering thermoplastics SHELL OIL COMPANY (US) 1993-04-27 — — US disclosed
US-5194510-A THERMOPLASTIC ELASTOMERS SHELL OIL COMPANY (US) 1993-03-16 — — US disclosed
EP-0458379-A2 Functionalized thermoplastic elastomers SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1991-11-27 — — EP disclosed
EP-0450694-A2 Process of producing functionalized elastomeric polymers SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1991-10-09 — — EP disclosed
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