SCHEMBL7338994

SCHEMBL7338994

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.57
MEN1 O00255 8/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
PRSS1 P07477 1/20 0.41
ACR P10323 1/20 0.41
MAPT P10636 6/20 0.41
CYP2C9 P11712 2/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
CYP1A2 P05177 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
POLB P06746 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HTT P42858 1/20 0.40
NLRP1 Q9C000 1/20 0.40
GAA P10253 1/20 0.40
CYP2C19 P33261 1/20 0.40
PKM P14618 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
SCHEMBL7330954 0.87 KMT2A (0.57) KMT2AMEN1SMN1; SMN2MAPTCYP2C9
SCHEMBL7339085 0.87 KMT2A (0.51) KMT2AMEN1SMN1; SMN2MAPTCYP2C9
SCHEMBL7329200 0.86 KMT2A (0.50) KMT2AMEN1SMN1; SMN2MAPTCYP2C9
SCHEMBL7337586 0.84 KMT2A (0.48) KMT2AMEN1SMN1; SMN2MAPTNPC1
SCHEMBL7336708 0.83 KMT2A (0.52) KMT2AMEN1SMN1; SMN2MAPTCYP2C9
SCHEMBL7340050 0.83 SMN1; SMN2 (0.54) KMT2AMEN1SMN1; SMN2MAPTCYP2C9
SCHEMBL7328819 0.82 KMT2A (0.56) KMT2AMEN1SMN1; SMN2MAPTNPC1
SCHEMBL7332183 0.81 KMT2A (0.57) KMT2AMEN1SMN1; SMN2PRSS1ACR
SCHEMBL7331661 0.81 ALDH1A1 (0.57) KMT2AMEN1SMN1; SMN2MAPTCYP2C9
SCHEMBL7331651 0.81 SMN1; SMN2 (0.58) KMT2AMEN1SMN1; SMN2MAPTCYP2C9

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