SCHEMBL10384657

SCHEMBL10384657

OCC1CCCCC(C2CCCCCC2)C1CO

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
TDP1 Q9NUW8 1/20 0.35
PABPC1 P11940 1/20 0.32
APOBEC3A P31941 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
CHRM1 P11229 1/20 0.31

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
SCHEMBL811603 0.91 CYP1A2 (0.34) CYP1A2CYP2D6TDP1CHRM1
SCHEMBL23524459 0.87 CYP1A2 (0.34) CYP1A2CYP2D6CHRM1
SCHEMBL13021351 0.84 CYP1A2 (0.44) CYP1A2CYP2D6TDP1PABPC1APOBEC3A
SCHEMBL5334077 0.83 CHRM1 (0.39) CYP1A2CYP2D6TDP1CHRM1
SCHEMBL21643876 0.81 TDP1 (0.43) TDP1PABPC1APOBEC3AAPOBEC3G
SCHEMBL7735125 0.79 CYP1A2 (0.49) CYP1A2CYP2D6TDP1PABPC1APOBEC3A
SCHEMBL2379725 0.79 CYP1A2 (0.49) CYP1A2CYP2D6TDP1PABPC1APOBEC3A
SCHEMBL13980744 0.75 ALDH1A1 (0.33) CYP1A2CYP2D6CHRM1
SCHEMBL25547590 0.75 TDP1 (0.34) CYP1A2CYP2D6TDP1PABPC1APOBEC3A
SCHEMBL28252848 0.74 CYP1A2 (0.35) CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119505197-A Low-temperature-cured high-toughness polyester resin and preparation method and application thereof 擎天材料科技有限公司 2025-02-25 CN claimed
US-4948866-A Process for preparing 2,3-bis(hydroxymethyl) bicyclo [2,2,1] heptane and polyester therewith GAF CHEMICALS CORPORATION (US) 1990-08-14 US claimed
CN-119505197-A Low-temperature-cured high-toughness polyester resin and preparation method and application thereof 擎天材料科技有限公司 2025-02-25 CN disclosed