SCHEMBL10531137

SCHEMBL10531137

Cc1cccc(C(=O)C[n+]2cc[nH]c2)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.47
▸ PABPC1 P11940 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ PARP1 P09874 1/20 0.42
▸ CTNNB1 P35222 4/20 0.42
▸ WNT3A P56704 4/20 0.42
▸ HPGD P15428 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ LMNA P02545 3/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39

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
Bromide SCHEMBL10529155 0.99 KMT2A (0.49) KMT2APABPC1ATMPARP1CTNNB1
SCHEMBL10528532 0.82 MAPT (0.49) KMT2APARP1CTNNB1WNT3ATDP1
SCHEMBL4394987 0.82 KMT2A (0.54) KMT2APABPC1ATMHPGDTDP1
Bromide SCHEMBL10526754 0.81 MAPT (0.51) PARP1CTNNB1WNT3ATDP1HDAC8
Bromide SCHEMBL10526748 0.81 ALDH1A1 (0.54) KMT2APABPC1ATMLMNAKDM4E
SCHEMBL10526705 0.80 KMT2A (0.43) KMT2AHPGDLMNAKDM4EALDH1A1
Bromide SCHEMBL10528580 0.79 KMT2A (0.43) KMT2AHPGDLMNAKDM4EALDH1A1
SCHEMBL10526761 0.77 HSD11B1 (0.42) KMT2ALMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL10529179 0.76 KMT2A (0.47) KMT2APABPC1ATMPARP1CTNNB1
Bromide SCHEMBL10531095 0.76 HSD11B1 (0.41) KMT2AHPGDLMNAKDM4EALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0182533-B1 3-(2-ARYL-2-OXOETHYL)-IMIDAZOLIUM SALTS AS HYPOGLYCEMIC AGENTS ELI LILLY AND COMPANY (US) 1989-09-20 — — EP claimed
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