SCHEMBL7185592

SCHEMBL7185592

O=Nc1ccccc1C(=O)c1ccc(O)cc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.57
▸ KMT2A Q03164 3/20 0.57
▸ USP2 O75604 1/20 0.57
▸ GAA P10253 1/20 0.57
▸ KEAP1 Q14145 1/20 0.57
▸ NFE2L2 Q16236 1/20 0.57
▸ CES2 O00748 1/20 0.48
▸ HPGD P15428 3/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ ALOX15 P16050 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ PGR P06401 1/20 0.47
▸ ADORA3 P0DMS8 1/20 0.47
▸ AR P10275 1/20 0.47
▸ CHRM1 P11229 1/20 0.47
▸ TBXA2R P21731 1/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ ADRA1A P35348 1/20 0.47

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
SCHEMBL24165283 0.88 CES2 (0.53) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL93207 0.82 MEN1 (0.69) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL29517975 0.82 MEN1 (0.69) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL6038446 0.82 ALDH1A1 (0.42) MEN1KMT2AUSP2GAACES2
SCHEMBL23544488 0.80 CES2 (0.45) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL29357695 0.80 CES2 (0.73) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL39507 0.80 CES2 (0.73) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL1174964 0.77 ALDH1A1 (0.68) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL7196004 0.77 LIG1 (0.61) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL30668331 0.77 ALDH1A1 (0.68) MEN1KMT2AUSP2GAAKEAP1

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
EP-1304924-A2 COMPOSITIONS FOR REPELLING CRAWLING INSECTS Bayer Aktiengesellschaft (DE) 2003-05-02 — — EP disclosed
WO-2002005646-A2 COMPOSITIONS FOR REPELLING CRAWLING INSECTS S.C. JOHNSON & SON, INC. (US) (US) 2002-01-24 — — WO disclosed
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