SCHEMBL9322192

SCHEMBL9322192

CS(=O)(=O)c1c(C(=O)O)ccc(Cl)c1Sc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.45
▸ KMT2A Q03164 6/20 0.45
▸ MEN1 O00255 5/20 0.45
▸ MAPT P10636 2/20 0.45
▸ LMNA P02545 2/20 0.44
▸ PTGS1 P23219 1/20 0.39
▸ PTGS2 P35354 1/20 0.39
▸ CA12 O43570 2/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA7 P43166 2/20 0.39
▸ CA13 Q8N1Q1 2/20 0.39
▸ CA3 P07451 1/20 0.39
▸ CA4 P22748 1/20 0.39
▸ CA6 P23280 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ CA14 Q9ULX7 1/20 0.39
▸ CA5B Q9Y2D0 1/20 0.39
▸ ALOX15 P16050 1/20 0.36
▸ HPGD P15428 2/20 0.36

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
SCHEMBL8387593 0.82 LMNA (0.49) ALDH1A1KMT2AMEN1MAPTLMNA
SCHEMBL9323152 0.75 ALDH1A1 (0.51) ALDH1A1KMT2AMEN1MAPTPTGS1
SCHEMBL9325317 0.75 PTGS1 (0.33) KMT2AMEN1PTGS1PTGS2CA12
SCHEMBL9322168 0.75 SIRT1 (0.50) ALDH1A1KMT2AMEN1MAPTCA12
SCHEMBL8390575 0.74 LMNA (0.41) ALDH1A1KMT2AMAPTLMNACA12
SCHEMBL23372785 0.73 ALDH1A1 (0.57) ALDH1A1KMT2AMEN1MAPTLMNA
SCHEMBL8387170 0.72 LMNA (0.51) ALDH1A1LMNAALOX15HPGDTDP1
SCHEMBL3647611 0.72 ALOX15 (0.62) ALDH1A1MAPTLMNACA12CA1
SCHEMBL8388401 0.72 LMNA (0.54) ALDH1A1KMT2AMEN1MAPTLMNA
SCHEMBL8491404 0.72 TSHR (0.55) ALDH1A1KMT2AMEN1MAPTLMNA

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-0580439-A1 Benzoylisoxazoles and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1994-01-26 — — EP disclosed
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