SCHEMBL28074223

SCHEMBL28074223

C=Cc1ccccc1C=C.O=C1C=C(c2ccccc2)C(=O)N1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.37
SIRT1 Q96EB6 2/20 0.37
SIRT3 Q9NTG7 1/20 0.37
SIRT5 Q9NXA8 1/20 0.37
BACE1 P56817 2/20 0.36
FLT3 P36888 2/20 0.35
PRKD3 O94806 2/20 0.34
PRKCG P05129 2/20 0.34
PRKCB P05771 2/20 0.34
PRKCA P17252 2/20 0.34
PRKCH P24723 2/20 0.34
PRKCI P41743 2/20 0.34
PRKCE Q02156 2/20 0.34
PRKCQ Q04759 2/20 0.34
PRKCZ Q05513 2/20 0.34
PRKCD Q05655 2/20 0.34
PRKD1 Q15139 2/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
ALDH1A1 P00352 3/20 0.33

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
Butadiene SCHEMBL28109974 0.88 BACE1 (0.39) SIRT2SIRT1SIRT3SIRT5BACE1
Styrene SCHEMBL2998387 0.87 ALDH1A1 (0.47) SIRT2SIRT1SIRT3SIRT5BACE1
Ethylene SCHEMBL27950511 0.86 BACE1 (0.43) BACE1PRKD3PRKCGPRKCBPRKCA
Benzene SCHEMBL29048034 0.86 BACE1 (0.46) BACE1PRKD3PRKCGPRKCBPRKCA
SCHEMBL41940 0.86 BACE1 (0.46) BACE1PRKD3PRKCGPRKCBPRKCA
Styrene SCHEMBL27911990 0.85 ALDH1A1 (0.45) SIRT2SIRT1SIRT3SIRT5BACE1
SCHEMBL30645576 0.84 BACE1 (0.45) BACE1PRKD3PRKCGPRKCBPRKCA
SCHEMBL28406785 0.84 BACE1 (0.45) BACE1PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL28877622 0.84 BACE1 (0.45) BACE1PRKD3PRKCGPRKCBPRKCA
Water SCHEMBL28751457 0.84 BACE1 (0.45) BACE1PRKD3PRKCGPRKCBPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107004828-A Composition for functional layer of nonaqueous secondary battery, functional layer for nonaqueous secondary battery, and nonaqueous secondary battery 日本瑞翁株式会社 2017-08-01 CN disclosed
CN-106029702-A Ultraviolet-curable resin composition and laminate 横滨橡胶株式会社 2016-10-12 CN disclosed