SCHEMBL8072880

SCHEMBL8072880

CC(CCl)c1ccc(C(=O)CCCCl)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP5 P45974 1/20 0.47
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.43
HSD17B3 P37058 7/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
HTR7 P34969 1/20 0.41
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PDE4B Q07343 1/20 0.38

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
SCHEMBL7790180 0.87 USP5 (0.45) USP5NPC1RAB9AHSD17B3L3MBTL1
SCHEMBL2923903 0.86 USP5 (0.64) USP5NPC1RAB9AHSD17B3L3MBTL1
SCHEMBL3682043 0.83 USP5 (0.47) USP5NPC1RAB9AHSD17B3L3MBTL1
SCHEMBL3671743 0.82 USP5 (0.50) USP5NPC1RAB9AL3MBTL1LMNA
SCHEMBL27724305 0.82 USP5 (0.46) USP5NPC1RAB9AHSD17B3L3MBTL1
SCHEMBL3668961 0.81 EPHX1 (0.49) USP5NPC1RAB9AHSD17B3L3MBTL1
SCHEMBL3674162 0.80 USP5 (0.44) USP5NPC1RAB9AHSD17B3L3MBTL1
SCHEMBL4489859 0.78 HSD17B3 (0.47) USP5NPC1RAB9AHSD17B3L3MBTL1
SCHEMBL29023173 0.77 NPC1 (0.45) USP5NPC1RAB9AHSD17B3L3MBTL1
SCHEMBL27500904 0.77 NPC1 (0.49) USP5NPC1HSD17B3L3MBTL1HTR7

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-6147216-A Intermediates useful for the preparation of antihistaminic piperidine derivatives MERRELL PHARMACEUTICALS INC. (US) 2000-11-14 US disclosed