SCHEMBL11227941

SCHEMBL11227941

C=C(C)c1ccccc1.[LiH]

nearest known ligand 0.94

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 4/20 0.46
▸ CES1 P23141 4/20 0.46
▸ LMNA P02545 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ XBP1 P17861 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TSHR P16473 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ DAO P14920 1/20 0.41
▸ NAPRT Q6XQN6 1/20 0.41
▸ ALOX12 P18054 1/20 0.40
▸ ACHE P22303 1/20 0.40
▸ ELANE P08246 1/20 0.39
▸ ESR1 P03372 1/20 0.39
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39

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
SCHEMBL4658909 1.00 CES2 (0.46) CES2CES1LMNAMAPTMEN1
SCHEMBL6467824 1.00 CES2 (0.46) CES2CES1LMNAMAPTMEN1
SCHEMBL6391506 1.00 CES2 (0.46) CES2CES1LMNAMAPTMEN1
Hydrogen Peroxide SCHEMBL7249472 0.97 CES2 (0.48) CES2CES1LMNAMAPTMEN1
SCHEMBL2905282 0.97 — —
SCHEMBL6577 0.97 — —
Benzene SCHEMBL28197619 0.97 CES2 (0.48) CES2CES1LMNAMAPTMEN1
SCHEMBL472891 0.97 CES2 (0.48) CES2CES1LMNAMAPTMEN1
SCHEMBL1331472 0.97 — —
SCHEMBL3267692 0.97 CES2 (0.48) CES2CES1LMNAMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112867739-B Method for producing polymer and flow reaction system for producing polymer 富士胶片株式会社 2023-05-02 — — CN disclosed
CN-111801358-B Method for producing polymer and flow reaction system for producing polymer 富士胶片株式会社 2022-12-16 — — CN disclosed
US-20180163056-A1 HYDROPHILIC CURABLE COMPOSITIONS MITSUI CHEMICALS, INC. (JP) 2018-06-14 — — US disclosed
US-20180036995-A1 HYDROPHILIC MONOLAYER FILM WITH OPTICAL FUNCTIONALITY AND STACK OF THE SAME MITSUI CHEMICALS, INC. (JP) 2018-02-08 — — US disclosed
EP-3270192-A1 HYDROPHILIC SINGLE-LAYER FILM HAVING OPTICAL FUNCTIONALITY, AND LAMINATE THEREOF Mitsui Chemicals, Inc. (JP) 2018-01-17 — — EP disclosed
EP-3081578-A1 COMPOSITION FOR HYDROPHILIC CURED PRODUCT Mitsui Chemicals, Inc. (JP) 2016-10-19 — — EP disclosed
CN-101238155-B Method of taking (meth)acrylic ester polymer out of liquid reaction mixture KURARAY CO 2011-05-04 — — CN disclosed
CN-1993415-B Rubber composition JSR CORP 2010-05-26 — — CN disclosed
CN-101238155-A Method of taking (meth)acrylic ester polymer out of liquid reaction mixture KURARAY CO (JP) 2008-08-06 — — CN disclosed
CN-1993415-A Rubber composition JSR CORP (JP) 2007-07-04 — — CN disclosed
US-4340690-A Cyclic organo carbonate and sulfite coupling agents for living polymers of conjugated dienes THE GOODYEAR TIRE & RUBBER COMPANY (US) 1982-07-20 — — US disclosed
US-4340691-A Linear organo carbonate coupling agents for living polymers of conjugated dienes THE GOODYEAR TIRE & RUBBER COMPANY (US) 1982-07-20 — — US disclosed
US-4301259-A FOR BROADENING MOLECULAR WEIGHT DISTRIBUTION AND RESULTING IN NEGLIBLE COLD FLOW THE GOODYEAR TIRE & RUBBER COMPANY (US) 1981-11-17 — — US disclosed
US-4301258-A OF BROADENED MOLECULAR WEIGHT DISTRIBUTION; HIGH IMPACT PLASTICS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1981-11-17 — — US disclosed
US-4075253-A A-METHYLSTYRENE-CONJUGATED DIENE OLIGOMER DILITHIUM DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JA) 1978-02-21 — — US disclosed
US-3975339-A Manufacture of polymers of net-shaped structure BASF AKTIENGESELLSCHAFT (DT) 1976-08-17 — — US disclosed
US-3951931-A Production of polymeric compounds having functional end groups BASF AKTIENGESELLSCHAFT (DT) 1976-04-20 — — US disclosed
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