SCHEMBL9754520

SCHEMBL9754520

O=S(=O)(NCCc1cc[c]c(F)c1)c1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
TBXA2R P21731 6/20 0.55
PRMT1 Q99873 1/20 0.51
ALDH1A1 P00352 2/20 0.49
TP53 P04637 1/20 0.49
GAA P10253 1/20 0.49
TAAR1 Q96RJ0 1/20 0.48
PPARG P37231 1/20 0.47
LSS P48449 1/20 0.47
F2 P00734 1/20 0.47
MAPT P10636 1/20 0.46

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
SCHEMBL9330609 0.80 MEN1 (0.68) MEN1KMT2ATBXA2RPRMT1ALDH1A1
SCHEMBL9131036 0.79 TBXA2R (0.82) MEN1KMT2ATBXA2RPRMT1ALDH1A1
SCHEMBL9754552 0.78 MEN1 (0.84) MEN1KMT2ATBXA2RPRMT1ALDH1A1
SCHEMBL1660980 0.77 POLB (0.41) MEN1KMT2AALDH1A1TAAR1
SCHEMBL10391959 0.77 MEN1 (0.60) MEN1KMT2ATBXA2RPRMT1ALDH1A1
SCHEMBL10391960 0.76 MEN1 (0.63) MEN1KMT2ATBXA2RPRMT1TP53
SCHEMBL1287281 0.74 PRMT1 (0.83) MEN1KMT2ATBXA2RPRMT1ALDH1A1
SCHEMBL9329269 0.74 TBXA2R (0.70) MEN1KMT2ATBXA2RPRMT1ALDH1A1
SCHEMBL9128731 0.73 TBXA2R (0.72) MEN1KMT2ATBXA2RPRMT1ALDH1A1
SCHEMBL9485346 0.73 TBXA2R (0.72) MEN1KMT2ATBXA2RPRMT1ALDH1A1

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
WO-1991013868-A1 PHENYLTHIOALKYLCARBOXYLIC ACID DERIVATIVES, METHOD FOR PREPARING THEM AND DRUGS CONTAINING THESE COMPOUNDS BOEHRINGER MANNHEIM GMBH (DE) 1991-09-19 WO disclosed