SCHEMBL7340814

SCHEMBL7340814

CCS(=O)(=O)Oc1cc(Cl)cc(OC(=O)c2ccc(NC(=O)C(C)C)cc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 1/20 0.40
MTNR1B P49286 1/20 0.40
RAB9A P51151 2/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MLYCD O95822 1/20 0.39
ENPP3 O14638 1/20 0.38
ENPP1 P22413 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
SCHEMBL7338290 0.89 KMT2A (0.46) KMT2ASMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL7335767 0.88 KMT2A (0.44) KMT2ASMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL7339865 0.86 KMT2A (0.55) KMT2ASMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL7341414 0.85 KMT2A (0.47) KMT2ASMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL7330761 0.85 KMT2A (0.54) KMT2ASMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL9835889 0.85 KMT2A (0.44) KMT2ASMN1; SMN2MEN1CA12CA1
SCHEMBL7333607 0.84 ENPP1 (0.53) KMT2ASMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL7333001 0.84 KMT2A (0.57) KMT2ASMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL7333046 0.84 KMT2A (0.50) KMT2ASMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL7338301 0.83 KMT2A (0.45) KMT2ASMN1; SMN2MEN1ALDH1A1HPGD

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