SCHEMBL11857097

SCHEMBL11857097

O=C(c1ccc(O)cc1O)c1ccccc1Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
USP2 O75604 1/20 0.61
GAA P10253 1/20 0.61
KEAP1 Q14145 1/20 0.61
NFE2L2 Q16236 1/20 0.61
ABCG2 Q9UNQ0 1/20 0.55
CES2 O00748 2/20 0.52
RECQL P46063 1/20 0.51
ALDH1A1 P00352 4/20 0.50
HPGD P15428 3/20 0.50
CYP3A4 P08684 2/20 0.50
ALOX15 P16050 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
TSHR P16473 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 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
SCHEMBL11843932 0.86 RECQL (0.51) MEN1KMT2AABCG2CES2RECQL
SCHEMBL93207 0.85 MEN1 (0.69) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL29517975 0.85 MEN1 (0.69) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL11115683 0.83 RECQL (0.49) CES2RECQLALDH1A1HPGDCYP3A4
SCHEMBL144223 0.83 KMT2A (0.57) MEN1KMT2AGAACES2RECQL
SCHEMBL11114781 0.83 MAPK14 (0.52) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL2924890 0.83 CES2 (0.58) MEN1KMT2AGAACES2RECQL
SCHEMBL29357695 0.82 CES2 (0.73) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL39507 0.82 CES2 (0.73) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL2482326 0.82 LMNA (0.77) MEN1KMT2AGAAABCG2RECQL

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
US-3985783-A Process for ring acylation of phenols THE DOW CHEMICAL COMPANY (US) 1976-10-12 US disclosed