SCHEMBL7338290

SCHEMBL7338290

CC(C)C(=O)Nc1ccc(C(=O)Oc2cc(Cl)cc(OS(C)(=O)=O)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 3/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MTNR1B P49286 2/20 0.41
MLYCD O95822 1/20 0.40
ENPP3 O14638 1/20 0.39
ENPP1 P22413 1/20 0.39
POLB P06746 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL7340814 0.89 KMT2A (0.44) KMT2AMEN1SMN1; SMN2ALDH1A1CA12
SCHEMBL7339865 0.88 KMT2A (0.55) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7330761 0.87 KMT2A (0.54) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7333607 0.86 ENPP1 (0.53) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7340280 0.86 KMT2A (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7333046 0.86 KMT2A (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7333001 0.86 KMT2A (0.57) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7343147 0.84 PPARG (0.52) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7343139 0.84 PPARG (0.52) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7319785 0.84 KMT2A (0.46) KMT2AMEN1SMN1; SMN2ALDH1A1CA12

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-0475531-B1 Benzoic acid phenylester compounds and elastase inhibiting compositions containing the same ASAHI CHEMICAL IND (JP) 1995-01-18 EP disclosed
EP-0475531-A1 Benzoic acid phenylester compounds and elastase inhibiting compositions containing the same Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1992-03-18 EP disclosed