SCHEMBL20791869

SCHEMBL20791869

CC(C)(C)c1csc(NC(=O)c2cc3cccc(Cl)c3s2)n1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 8/20 0.65
▸ RAB9A P51151 7/20 0.65
▸ KDM4E B2RXH2 5/20 0.65
▸ NPSR1 Q6W5P4 4/20 0.65
▸ LMNA P02545 4/20 0.65
▸ HSD17B10 Q99714 2/20 0.65
▸ HTT P42858 2/20 0.65
▸ ALDH1A1 P00352 4/20 0.61
▸ HPGD P15428 2/20 0.61
▸ MAPK1 P28482 2/20 0.61
▸ ALOX15 P16050 1/20 0.61
▸ TSHR P16473 1/20 0.61
▸ MAPT P10636 3/20 0.60
▸ HDAC3 O15379 1/20 0.59
▸ HDAC4 P56524 1/20 0.59
▸ HDAC1 Q13547 1/20 0.59
▸ HDAC7 Q8WUI4 1/20 0.59
▸ HDAC2 Q92769 1/20 0.59
▸ HDAC10 Q969S8 1/20 0.59
▸ HDAC11 Q96DB2 1/20 0.59

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
SCHEMBL20791871 0.84 NPC1 (0.63) NPC1RAB9AKDM4ENPSR1LMNA
SCHEMBL20769725 0.82 RAB9A (0.65) NPC1RAB9AKDM4ENPSR1LMNA
SCHEMBL20787910 0.79 NPC1 (1.00) NPC1RAB9AKDM4ENPSR1LMNA
SCHEMBL12296355 0.76 NPC1 (1.00) NPC1RAB9AKDM4ENPSR1LMNA
SCHEMBL20788014 0.75 NPC1 (0.68) NPC1RAB9AKDM4ENPSR1LMNA
SCHEMBL20769658 0.74 RAB9A (0.60) NPC1RAB9AKDM4ENPSR1LMNA
SCHEMBL20787900 0.74 NPC1 (0.63) NPC1RAB9AKDM4ENPSR1LMNA
SCHEMBL20787903 0.74 NPC1 (0.74) NPC1RAB9AKDM4ENPSR1LMNA
SCHEMBL20791859 0.74 NPC1 (0.76) NPC1RAB9AKDM4ENPSR1LMNA
SCHEMBL22728466 0.74 NPC1 (0.66) NPC1RAB9AKDM4ENPSR1LMNA

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
WO-2019046668-A1 AMIDE SUBSTITUTED THIAZOLES AS PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2019-03-07 — — WO disclosed
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