SCHEMBL7603972

SCHEMBL7603972

O=C1C=CC(=O)N1c1ccc(Cl)c(Cl)c1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 5/20 0.46
▸ NOTUM Q6P988 13/20 0.42
▸ TLR9 Q9NR96 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CHRNB2 P17787 1/20 0.39
▸ CYP2B6 P20813 1/20 0.39
▸ MAOA P21397 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ CHRNA4 P43681 1/20 0.39
▸ HTR3A P46098 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ CCR6 P51684 1/20 0.36
▸ CACNA1B Q00975 1/20 0.36
▸ APBA1 Q02410 1/20 0.36

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
SCHEMBL5178841 0.77 MGLL (0.55) MGLLNOTUMTLR9ALDH1A1HSP90AA1
SCHEMBL27817597 0.70 NOTUM (0.67) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL2343843 0.68 MGLL (0.70) MGLLTLR9MAPT
SCHEMBL7178401 0.67 MGLL (0.52) MGLLTLR9ALDH1A1HSP90AA1MAPT
SCHEMBL5943005 0.67 TLR9 (0.46) MGLLTLR9
SCHEMBL23844538 0.66 MGLL (0.39) MGLLTLR9
SCHEMBL28883506 0.66 MGLL (0.60) MGLLTLR9CYP1A2ALDH1A1HSP90AA1
SCHEMBL26448259 0.65 AR (0.49) —
SCHEMBL30793026 0.65 MGLL (0.45) MGLLTLR9ALDH1A1HSP90AA1PKM
SCHEMBL9155405 0.64 MGLL (0.59) MGLLTLR9ALDH1A1HSP90AA1MAPT

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-0726252-B1 Process for the preparation of N-substituted cyclic imides BAYER AG (DE) 2002-04-17 — — EP disclosed
EP-0726252-A1 Process for the preparation of N-substituted cyclic imides BAYER AG (DE) 1996-08-14 — — EP disclosed
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