SCHEMBL31489254

SCHEMBL31489254

Cc1c(N)ncc(F)c1Br

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
NOS3 P29474 2/20 0.35
NOS2 P35228 2/20 0.35
HTT P42858 2/20 0.35
KMT2A Q03164 1/20 0.35
NOS1 P29475 1/20 0.35
DAO P14920 1/20 0.32
UHRF1 Q96T88 1/20 0.31
VRK1 Q99986 1/20 0.31
SYK P43405 1/20 0.30
MET P08581 1/20 0.30
USP7 Q93009 1/20 0.30
BCL6 P41182 1/20 0.30

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
SCHEMBL30867865 0.83 LMNA (0.41) LMNANOS3NOS2HTTKMT2A
SCHEMBL14853133 0.83 LMNA (0.41) LMNANOS3NOS2HTTKMT2A
SCHEMBL31489845 0.77 HTT (0.38) HTTKMT2AVRK1BCL6
SCHEMBL12377647 0.77 HTT (0.38) HTTKMT2AVRK1BCL6
SCHEMBL22809671 0.77 NOS3 (0.38) LMNANOS3NOS2NOS1DAO
SCHEMBL24033512 0.76 HTT (0.41) LMNANOS3NOS2HTTKMT2A
SCHEMBL31041294 0.76 HTT (0.41) LMNANOS3NOS2HTTKMT2A
SCHEMBL13695116 0.74 LMNA (0.37) LMNANOS3NOS2HTTKMT2A
SCHEMBL31489236 0.74 DAO (0.32) DAO
SCHEMBL29431111 0.74 HTT (0.35) HTTKMT2AVRK1BCL6

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-2025072395-A1 TRIAZOLOPYRIDINYL COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-04-03 WO disclosed