SCHEMBL32060705

SCHEMBL32060705

Cc1cccc(C)c1NC(=O)c1ccccn1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.69
RAB9A P51151 4/20 0.69
TDP1 Q9NUW8 1/20 0.56
PKM P14618 2/20 0.55
LCK P06239 1/20 0.54
POLB P06746 1/20 0.54
GRM4 Q14833 4/20 0.54
HDAC6 Q9UBN7 2/20 0.54
KDR P35968 2/20 0.54
MAPK1 P28482 1/20 0.53
LMNA P02545 1/20 0.53
NAPRT Q6XQN6 1/20 0.53
P4HTM Q9NXG6 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HDAC3 O15379 1/20 0.53
HDAC4 P56524 1/20 0.53
HDAC1 Q13547 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC10 Q969S8 1/20 0.53

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
SCHEMBL10038817 1.00 NPC1 (0.69) NPC1RAB9ATDP1PKMLCK
SCHEMBL29643958 0.88 NPC1 (0.59) NPC1RAB9ATDP1PKMPOLB
SCHEMBL28623980 0.88 NPC1 (0.59) NPC1RAB9ATDP1PKMPOLB
SCHEMBL14825173 0.84 POLB (0.56) NPC1RAB9ATDP1POLBMAPK1
SCHEMBL29531380 0.83 NPC1 (0.79) NPC1RAB9APKMPOLBGRM4
SCHEMBL12437777 0.83 NPC1 (0.79) NPC1RAB9APKMPOLBGRM4
SCHEMBL31501093 0.82 NPC1 (0.49) NPC1RAB9APOLBMAPK1L3MBTL1
SCHEMBL21620972 0.82 NPC1 (1.00) NPC1RAB9AGRM4HDAC6LMNA
SCHEMBL19476175 0.82 NPC1 (0.52) NPC1RAB9ATDP1PKMPOLB
SCHEMBL22204798 0.81 NPC1 (0.51) NPC1RAB9ATDP1PKMPOLB

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
EP-4686757-A1 INHIBITORS OF EXPRESSION AND/OR FUNCTION e-therapeutics PLC (GB) 2026-02-04 EP disclosed