SCHEMBL17991985

SCHEMBL17991985

CN(C)N=Nc1ccc(Cc2ccc(OS(=O)(=O)O)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ STS P08842 1/20 0.42
▸ LTA4H P09960 7/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ ELANE P08246 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ GAA P10253 1/20 0.33

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
SCHEMBL17991992 0.87 LMNA (0.49) LMNAMAPTNPC1RAB9AKDM4E
SCHEMBL17992004 0.84 LMNA (0.54) LMNAMAPTNPC1RAB9AKDM4E
SCHEMBL17991993 0.83 LMNA (0.45) LMNAMAPTNPC1RAB9ASTS
SCHEMBL14699614 0.83 MAPT (0.50) LMNAMAPTNPC1RAB9ASTS
SCHEMBL17988686 0.83 MAPT (0.50) LMNAMAPTNPC1RAB9ASTS
SCHEMBL17988684 0.82 STS (0.41) LMNANPC1RAB9ASTSLTA4H
SCHEMBL17992015 0.80 LMNA (0.42) LMNAMAPTNPC1RAB9ASTS
SCHEMBL2475726 0.79 LMNA (0.50) LMNAMAPTNPC1RAB9AKDM4E
SCHEMBL17991987 0.78 MAPT (0.43) LMNAMAPTNPC1RAB9AKDM4E
SCHEMBL17991983 0.76 STS (0.53) LMNAMAPTNPC1RAB9ASTS

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-9409859-B2 Substituted diphenyl derivatives CREATIVE THERAPEUTICS GMBH (DE) 2016-08-09 — — US disclosed
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