SCHEMBL7342155

SCHEMBL7342155

CC(C)C(=O)Nc1ccc(C(=O)Oc2cccc(F)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.52
▸ KMT2A Q03164 7/20 0.52
▸ RAB9A P51151 5/20 0.52
▸ MAPT P10636 4/20 0.52
▸ NPC1 O15118 3/20 0.52
▸ MTNR1B P49286 3/20 0.51
▸ ATM Q13315 1/20 0.50
▸ ALDH1A1 P00352 5/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ HPGD P15428 2/20 0.49
▸ ESR1 P03372 1/20 0.49
▸ ESR2 Q92731 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ MLYCD O95822 1/20 0.48
▸ MTNR1A P48039 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL7329888 0.88 MLYCD (0.51) MEN1KMT2ARAB9AMAPTNPC1
SCHEMBL14521766 0.86 MAPT (0.54) MEN1KMT2ARAB9AMAPTMTNR1B
SCHEMBL7336070 0.85 MLYCD (0.52) MEN1KMT2ARAB9ANPC1MTNR1B
SCHEMBL7337966 0.85 ALDH1A1 (0.54) MEN1KMT2ARAB9AMAPTNPC1
SCHEMBL7331326 0.84 PRSS1 (0.56) MEN1KMT2ARAB9AMAPTMTNR1B
SCHEMBL7340407 0.84 MLYCD (0.47) MEN1KMT2ARAB9AMAPTNPC1
SCHEMBL7334099 0.82 MEN1 (0.49) MEN1KMT2ARAB9AMAPTNPC1
SCHEMBL7342059 0.81 KMT2A (0.58) MEN1KMT2ARAB9AMAPTNPC1
SCHEMBL7335748 0.81 MEN1 (0.51) MEN1KMT2ARAB9AMAPTNPC1
SCHEMBL7332045 0.80 ALDH1A1 (0.52) MEN1KMT2ARAB9AMAPTNPC1

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
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