SCHEMBL10424693

SCHEMBL10424693

Cc1cc(-c2ccc(F)cc2)c(CBr)c(C)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 2/20 0.43
DPP4 P27487 3/20 0.41
HMGCR P04035 1/20 0.40
POLB P06746 1/20 0.39
STAT1 P42224 1/20 0.38
HTT P42858 1/20 0.37
ADORA2A P29274 1/20 0.37
ADORA2B P29275 1/20 0.37
ADORA1 P30542 1/20 0.37
GCGR P47871 2/20 0.35
APP P05067 1/20 0.35
MAPK14 Q16539 1/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL6956576 0.85 GCGR (0.46) NPC1RAB9ASMN1; SMN2MEN1KMT2A
Bromide SCHEMBL10423947 0.75 STAT1 (0.40) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL10511491 0.74 NPC1 (0.43) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL6956685 0.71 HMGCR (0.51) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL8051661 0.71 MEN1 (0.51) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL8949704 0.71 NPC1 (0.43) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL6963687 0.71 GCGR (0.62) HMGCRGCGR
SCHEMBL29222898 0.69 NPC1 (0.45) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL6959002 0.69 HMGCR (0.52) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL9270667 0.69 HMGCR (0.52) NPC1RAB9ASMN1; SMN2MEN1KMT2A

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-4925852-A TREATMENT OR PROPHYLAXIS OF ARTERIOSCLEROSIS OR HYPERCHOLESTEROLEMIA HOECHST AKTIENGESELLSCHAFT (DE) 1990-05-15 US disclosed