SCHEMBL10577402

SCHEMBL10577402

CC(C)c1nc2ccc(C(C)(C)CNC=O)cc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 14/20 0.46
▸ KDM4E B2RXH2 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ MMP1 P03956 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ MMP7 P09237 1/20 0.38
▸ CYP1A2 P05177 1/20 0.37
▸ KCNH2 Q12809 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
SCHEMBL10577394 0.90 KDM4E (0.42) SCN10AKDM4ELMNAHSD17B10ALDH1A1
SCHEMBL10578941 0.84 MAPT (0.51) SCN10AKDM4EHSD17B10ALDH1A1KCNH2
SCHEMBL10575570 0.82 PLAU (0.42) SCN10AHSD17B10ALDH1A1KCNH2
SCHEMBL10579210 0.82 SCN10A (0.38) SCN10AHSD17B10KCNH2
SCHEMBL10694817 0.82 SCN10A (0.40) SCN10AHSD17B10KCNH2
SCHEMBL10577964 0.81 HPGD (0.47) SCN10AHSD17B10ALDH1A1CYP1A2KCNH2
SCHEMBL12404648 0.80 SCN10A (0.54) SCN10AKDM4ELMNAHSD17B10ALDH1A1
SCHEMBL10579387 0.80 KDM4E (0.48) SCN10AKDM4ELMNAALDH1A1
SCHEMBL10579145 0.79 CACNA1H (0.39) SCN10ALMNAALDH1A1KCNH2
SCHEMBL10578090 0.79 TRPV1 (0.47) SCN10AKDM4ELMNAALDH1A1KCNH2

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
US-4882342-A CARDIOVASCULAR DISORDERS BOEHRINGER MANNHEIM GMBH (DE) 1989-11-21 — — US disclosed
EP-0266558-A2 5-Alkylbenzimidazoles, process for their preparation and medicaments containing them Roche Diagnostics GmbH (DE) 1988-05-11 — — EP disclosed
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