SCHEMBL10823710

SCHEMBL10823710

O=C(Nc1cccc(S(=O)(=O)Nc2ccc3cc(S(=O)(=O)O)c(O)cc3c2)c1)Nc1cccc(S(=O)(=O)Nc2ccc3cc(S(=O)(=O)O)c(O)cc3c2)c1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ IDH1 O75874 2/20 0.48
▸ AKR1C3 P42330 1/20 0.48
▸ PKM P14618 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ PRMT1 Q99873 1/20 0.46

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
SCHEMBL10823450 0.88 CA2 (0.49) MEN1KMT2AALDH1A1PRMT1
SCHEMBL6078231 0.86 MEN1 (0.56) MEN1KMT2AIDH1AKR1C3PKM
SCHEMBL6079410 0.84 MEN1 (0.55) MEN1KMT2AIDH1AKR1C3PKM
SCHEMBL6078878 0.84 MEN1 (0.55) MEN1KMT2AIDH1AKR1C3PKM
SCHEMBL6078621 0.84 MEN1 (0.55) MEN1KMT2AIDH1AKR1C3PKM
SCHEMBL6079569 0.84 MEN1 (0.55) MEN1KMT2AIDH1AKR1C3PKM
SCHEMBL10823476 0.84 PRMT1 (0.62) MEN1KMT2APKMPRMT1
SCHEMBL10823613 0.84 PRMT1 (0.49) IDH1AKR1C3PKMPRMT1
SCHEMBL7630246 0.84 MEN1 (0.62) MEN1KMT2AAKR1C3PKMALDH1A1
SCHEMBL6079560 0.83 MEN1 (0.54) MEN1KMT2AIDH1AKR1C3PKM

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
US-H83-H Dental antiplaque agents and inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1986-07-01 — — US disclosed
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