SCHEMBL10953475

SCHEMBL10953475

CC(C)=NOCOC(=O)C(C)Oc1ccc(Oc2ccc3cc(F)ccc3n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ GMNN O75496 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ APEX1 P27695 1/20 0.39
▸ PMP22 Q01453 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ ALOX5 P09917 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ SCN9A Q15858 6/20 0.35
▸ MEN1 O00255 1/20 0.35

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
SCHEMBL10984246 0.87 ALDH1A1 (0.53) MAPTLMNASMN1; SMN2ALDH1A1TP53
SCHEMBL11015791 0.87 ALDH1A1 (0.48) MAPTLMNASMN1; SMN2ALDH1A1TP53
SCHEMBL10915307 0.86 TSHR (0.46) MAPTLMNASMN1; SMN2ALDH1A1TP53
SCHEMBL11304752 0.84 GAA (0.44) MAPTLMNASMN1; SMN2ALDH1A1TP53
SCHEMBL11404881 0.83 MAPT (0.50) MAPTLMNASMN1; SMN2ALDH1A1TP53
SCHEMBL10838863 0.81 CYP1A2 (0.43) MAPTLMNASMN1; SMN2ALDH1A1TP53
SCHEMBL8677802 0.81 MAPT (0.48) MAPTLMNASMN1; SMN2ALDH1A1TP53
Hydrochloric Acid SCHEMBL10947196 0.80 CYP1A2 (0.43) MAPTLMNASMN1; SMN2ALDH1A1TP53
SCHEMBL9587752 0.80 MAPT (0.45) MAPTLMNASMN1; SMN2ALDH1A1TP53
SCHEMBL10839077 0.79 MAPT (0.42) MAPTLMNASMN1; SMN2ALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0052798-B1 OXIME ESTERS, PROCESSES FOR THEIR PREPARATION, THEIR USE AND COMPOSITIONS CONTAINING THESE ESTERS F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1985-05-08 — — EP claimed
US-4435207-A Quinyloxy-phenyloxy-oxime ester compounds having herbicidal activity HOFFMANN-LA ROCHE INC. (US) 1984-03-06 — — US claimed
US-4545807-A Oxime ester herbicides HOFFMANN-LA ROCHE INC. (US) 1985-10-08 — — US disclosed
US-4435207-A Quinyloxy-phenyloxy-oxime ester compounds having herbicidal activity HOFFMANN-LA ROCHE INC. (US) 1984-03-06 — — US disclosed
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