SCHEMBL11287147

SCHEMBL11287147

Fc1ccc(-c2nc(-c3ccccc3)c(-c3ccc(F)cc3)s2)cc1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 11/20 0.74
ALOX5 P09917 1/20 0.69
PTGDR2 Q9Y5Y4 2/20 0.58
PTGS1 P23219 1/20 0.52
ALDH1A1 P00352 2/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2D6 P10635 2/20 0.51
CYP2C19 P33261 2/20 0.51
MAPT P10636 1/20 0.51
KDM4E B2RXH2 1/20 0.50
CYP3A4 P08684 1/20 0.50
GAA P10253 1/20 0.50
CYP2C9 P11712 1/20 0.50

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
SCHEMBL6282345 0.92 PTGS2 (0.68) PTGS2ALOX5PTGDR2
SCHEMBL9768642 0.89 ALDH1A1 (0.62) PTGS2ALOX5PTGDR2ALDH1A1CYP1A2
SCHEMBL7845380 0.86 PTGS2 (0.77) PTGS2ALOX5PTGS1
SCHEMBL7832424 0.86 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL21670773 0.84 PTGS2 (0.56) PTGS2ALOX5PTGDR2ALDH1A1CYP1A2
SCHEMBL11460695 0.83 KDM4E (0.58) PTGS2ALOX5PTGDR2ALDH1A1CYP1A2
SCHEMBL11284205 0.83 KDM4E (0.58) PTGS2ALOX5PTGDR2ALDH1A1CYP1A2
SCHEMBL12245630 0.83 ALOX5 (0.69) PTGS2ALOX5PTGS1ALDH1A1CYP1A2
SCHEMBL11462189 0.83 KDM4E (0.58) PTGS2ALOX5PTGDR2ALDH1A1CYP1A2
SCHEMBL10506565 0.82 PTGS2 (0.78) PTGS2ALOX5PTGDR2ALDH1A1MAPT

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
US-4322428-A 2(4-Fluorophenyl)-4,5,-bis(4-methoxyphenyl)thiazole and method of use ELI LILLY AND COMPANY (US) 1982-03-30 US disclosed
EP-0037274-A1 Substituted triaryl thiazole compounds ELI LILLY AND COMPANY (US) 1981-10-07 EP disclosed