SCHEMBL6253050

SCHEMBL6253050

CCCC[C@@H]1CCCC[C@@H]1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.42
ALOX5 P09917 1/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
PEPD P12955 1/20 0.36

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
SCHEMBL28028180 1.00 CYP1A2 (0.42) CYP1A2ALOX5CA1CA2CA4
SCHEMBL6009846 0.94 ALOX5 (0.47) ALOX5CA1CA2CA4ALDH1A1
SCHEMBL850823 0.93 ALOX5 (0.50) ALOX5ALDH1A1
SCHEMBL18787432 0.91 ALOX5 (0.47) ALOX5ALDH1A1PEPD
SCHEMBL8856246 0.89 ALOX5 (0.50) ALOX5ALDH1A1PEPD
SCHEMBL10322322 0.88 ALOX5 (0.47) CYP1A2ALOX5USP2ALDH1A1GAA
SCHEMBL8459562 0.84 ALOX5 (0.38) CYP1A2ALOX5USP2ALDH1A1GAA
SCHEMBL28425229 0.83 EPHX1 (0.47) CYP1A2ALOX5CA1CA2CA4
SCHEMBL6009936 0.82 ALOX5 (0.55) ALOX5ALDH1A1
SCHEMBL30922203 0.82 ALOX5 (0.37) CYP1A2ALOX5USP2ALDH1A1GAA

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
EP-0884309-B1 Optically active compound, antiferroelectric liquid crystal composition containing the same, process for producing the same and process for producing optically active carboxylic acid SEMICONDUCTOR ENERGY LAB (JP) 2005-09-07 EP disclosed
US-5965059-A Optically active compound, antiferroelectric liquid crystal composition containing the same, process for producing the same and process for producing an optically active carboxylic acid TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-10-12 US disclosed
EP-0884309-A1 Optically active compound, antiferroelectric liquid crystal composition containing the same, process for producing the same and process for producing optically active carboxylic acid Takasago International Corporation (JP) 1998-12-16 EP disclosed