SCHEMBL31276388

SCHEMBL31276388

Brc1cnn(-c2ccccc2)c1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.53
NPSR1 Q6W5P4 4/20 0.53
ALDH1A1 P00352 4/20 0.53
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
HTT P42858 3/20 0.53
MAPT P10636 1/20 0.53
PAX8 Q06710 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
PTGS2 P35354 6/20 0.51
PTGS1 P23219 5/20 0.51
HIF1A Q16665 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
PDE4B Q07343 1/20 0.42
NR3C1 P04150 1/20 0.41

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
SCHEMBL31276196 0.96 LMNA (0.56) LMNANPSR1ALDH1A1NPC1RAB9A
SCHEMBL31276891 0.91 LMNA (0.51) LMNANPSR1ALDH1A1NPC1RAB9A
SCHEMBL31276191 0.88 PTGS1 (0.66) LMNANPSR1ALDH1A1NPC1RAB9A
SCHEMBL31275605 0.88 LMNA (0.49) LMNANPSR1ALDH1A1NPC1RAB9A
SCHEMBL31275608 0.88 LMNA (0.58) LMNANPSR1ALDH1A1NPC1RAB9A
SCHEMBL31276119 0.88 PTGS2 (0.50) LMNANPSR1ALDH1A1NPC1RAB9A
SCHEMBL31276345 0.85 LMNA (0.46) LMNANPSR1ALDH1A1NPC1RAB9A
SCHEMBL31276318 0.85 PTGS2 (0.52) LMNANPSR1ALDH1A1NPC1RAB9A
SCHEMBL31276291 0.85 PTGS2 (0.66) LMNANPSR1ALDH1A1NPC1RAB9A
SCHEMBL31276340 0.84 HIF1A (0.50) LMNANPSR1ALDH1A1NPC1RAB9A

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
CN-119019332-A 1, 5-Disubstituted-4-bromopyrazole compound and preparation method and application thereof 赣南师范大学 2024-11-26 CN disclosed