SCHEMBL9493775

SCHEMBL9493775

Clc1ccc(Oc2cccc(/C=C/C[PH](c3ccccc3)(c3ccccc3)c3ccccc3)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EPOR P19235 4/20 0.48
▸ ALOX5 P09917 4/20 0.46
▸ PTGS1 P23219 2/20 0.46
▸ PTGS2 P35354 2/20 0.46
▸ ALOX5AP P20292 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TLR4 O00206 1/20 0.44
▸ TLR2 O60603 1/20 0.44
▸ TERT O14746 1/20 0.40
▸ ADAMTS5 Q9UNA0 1/20 0.40
▸ PPARG P37231 3/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ LCK P06239 1/20 0.38

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
SCHEMBL9493790 1.00 EPOR (0.48) EPORALOX5PTGS1PTGS2ALOX5AP
SCHEMBL9493815 0.92 EPOR (0.55) EPORALOX5PTGS1PTGS2ALOX5AP
SCHEMBL9493808 0.92 EPOR (0.55) EPORALOX5PTGS1PTGS2ALOX5AP
SCHEMBL9491925 0.80 ALDH1A1 (0.50) EPORALOX5PTGS1PTGS2ALOX5AP
SCHEMBL9491939 0.80 ALDH1A1 (0.50) EPORALOX5PTGS1PTGS2ALOX5AP
Hydrochloric Acid SCHEMBL9492580 0.77 EPOR (0.46) EPORALOX5PTGS1PTGS2ALOX5AP
Hydrochloric Acid SCHEMBL9493052 0.77 EPOR (0.46) EPORALOX5PTGS1PTGS2ALOX5AP
SCHEMBL9130834 0.75 ALOX5 (0.59) EPORALOX5PTGS1PTGS2ALOX5AP
SCHEMBL9492646 0.75 EPOR (0.58) EPORALOX5PTGS1PTGS2ALOX5AP
SCHEMBL9130816 0.75 ALOX5 (0.59) EPORALOX5PTGS1PTGS2ALOX5AP

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
EP-0279531-B1 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF INSECTICIDALLY ACTIVE COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-03-10 — — EP claimed
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