SCHEMBL29092018

SCHEMBL29092018

C=C(C(=O)OC)C1(CC)CCCC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
ALDH1A1 P00352 1/20 0.37
CETP P11597 1/20 0.36
NPSR1 Q6W5P4 1/20 0.33
CYP2C19 P33261 1/20 0.31
MME P08473 4/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL27634327 0.98 CETP (0.38) CYP4F2CYP4A11ALDH1A1CETPNPSR1
SCHEMBL29092050 0.85 CYP4F2 (0.40) CYP4F2CYP4A11ALDH1A1CETPNPSR1
SCHEMBL29092817 0.84 CETP (0.40) CYP4F2CYP4A11ALDH1A1CETPNPSR1
SCHEMBL28875572 0.81 CYP4F2 (0.44) CYP4F2CYP4A11ALDH1A1CETPCYP2C19
SCHEMBL631303 0.79 ALDH1A1 (0.35) ALDH1A1
SCHEMBL990466 0.78 CYP2C19 (0.39) CYP4F2CYP4A11CETPCYP2C19MME
SCHEMBL7199423 0.77 ALDH1A1 (0.37) CYP4F2CYP4A11ALDH1A1CETP
SCHEMBL21314217 0.77 ALDH1A1 (0.33) ALDH1A1
SCHEMBL10542184 0.76 CETP (0.39) CYP4F2CYP4A11ALDH1A1CETPCYP2C19
SCHEMBL3968163 0.76 CYP2C19 (0.42) CYP4F2CYP4A11ALDH1A1CETPCYP2C19

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-117561385-A Transmission belt 戴科欧洲有限公司 2024-02-13 CN disclosed
CN-116940601-A Process for producing reversible addition-fragmentation chain transfer polymer 富士胶片株式会社 2023-10-24 CN disclosed
CN-116888168-A Process for producing desulfurization carbonyl sulfide polymer 富士胶片株式会社 2023-10-13 CN disclosed