SCHEMBL7330717

SCHEMBL7330717

CC(C)C(=O)Nc1ccc(C(=O)Oc2cc(Cl)cc(OC(=O)C=Cc3ccccc3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.46
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
RAB9A P51151 3/20 0.45
HPGD P15428 2/20 0.45
HTT P42858 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
MEN1 O00255 5/20 0.44
MAPT P10636 3/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
EGFR P00533 5/20 0.44
MMP1 P03956 2/20 0.44
MMP2 P08253 2/20 0.44
MMP9 P14780 2/20 0.44
RXFP1 Q9HBX9 1/20 0.41
LMNA P02545 3/20 0.40
NPC1 O15118 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MTNR1B P49286 1/20 0.40

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
SCHEMBL7330713 1.00 KMT2A (0.46) KMT2AALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL7343147 0.85 PPARG (0.52) KMT2AALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL7343139 0.85 PPARG (0.52) KMT2AALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL7339865 0.83 KMT2A (0.55) KMT2AALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL7330761 0.82 KMT2A (0.54) KMT2AALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL7341981 0.82 EGFR (0.66) KMT2AALDH1A1SMN1; SMN2RAB9ANPSR1
SCHEMBL7341979 0.82 EGFR (0.66) KMT2AALDH1A1SMN1; SMN2RAB9ANPSR1
SCHEMBL7333046 0.81 KMT2A (0.50) KMT2AALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL7333001 0.81 KMT2A (0.57) KMT2AALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL7339796 0.80 KMT2A (0.60) KMT2AALDH1A1SMN1; SMN2RAB9AHPGD

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