SCHEMBL29327468

SCHEMBL29327468

C=CCOC(=O)CCc1cc(C)c(O)c(C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALOX5 P09917 1/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
ALDH1A1 P00352 5/20 0.39
CASP1 P29466 1/20 0.39
S1PR1 P21453 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
CYP4Z1 Q86W10 1/20 0.38
APP P05067 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
CYP3A4 P08684 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
SCHEMBL6071507 0.84 ALOX5 (0.52) ALOX5CYP4F2CYP4A11ALDH1A1S1PR1
SCHEMBL15080678 0.84 CYP4F2 (0.46) ALOX5CYP4F2CYP4A11ALDH1A1S1PR1
SCHEMBL889921 0.82 CYP4F2 (0.57) ALOX5CYP4F2CYP4A11ALDH1A1CASP1
SCHEMBL175628 0.81 GAA (0.52) TSHRPKMSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL12352182 0.81 CYP4F2 (0.47) ALOX5CYP4F2CYP4A11ALDH1A1S1PR1
SCHEMBL12919720 0.81 CYP4F2 (0.44) ALOX5CYP4F2CYP4A11ALDH1A1S1PR1
SCHEMBL19047012 0.81 ALOX5 (0.57) ALOX5CYP4F2CYP4A11ALDH1A1S1PR1
SCHEMBL9389048 0.81 PKM (0.40) TSHRPKMSMN1; SMN2ALOX5ALDH1A1
SCHEMBL17264213 0.80 ALOX5 (0.49) ALOX5CYP4F2CYP4A11ALDH1A1S1PR1
SCHEMBL2045372 0.80 ALOX5 (0.49) ALOX5CYP4F2CYP4A11ALDH1A1S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024151676-A1 SILANE FUNCTIONAL STABILIZERS FOR EXTENDING LONG-TERM ELECTRICAL POWER CABLE PERFORMANCE SOUTHWIRE COMPANY, LLC (US) 2024-07-18 WO disclosed