SCHEMBL31489764

SCHEMBL31489764

CC(c1ccccc1)n1cc(I)cn1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 12/20 0.51
BRD4 O60885 5/20 0.41
CYP2D6 P10635 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B10 Q99714 2/20 0.40
HPGD P15428 1/20 0.40
KLKB1 P03952 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
CASP1 P29466 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL31489905 1.00 CREBBP (0.51) CREBBPBRD4CYP2D6MEN1KMT2A
SCHEMBL23022268 0.85 CREBBP (0.56) CREBBPKDM4ELMNA
SCHEMBL31489752 0.84 CREBBP (0.52) CREBBPBRD4HSD17B10LMNANPSR1
SCHEMBL31489479 0.84 CREBBP (0.52) CREBBPBRD4HSD17B10LMNANPSR1
SCHEMBL31489224 0.83 CREBBP (0.39) CREBBP
SCHEMBL31489591 0.83 CREBBP (0.39) CREBBP
SCHEMBL19538823 0.80 CREBBP (0.52) CREBBPBRD4CYP2D6MEN1KMT2A
SCHEMBL19531660 0.80 CREBBP (0.52) CREBBPBRD4CYP2D6MEN1KMT2A
SCHEMBL19531635 0.80 CREBBP (0.52) CREBBPBRD4CYP2D6MEN1KMT2A
SCHEMBL19538830 0.80 CREBBP (0.52) CREBBPBRD4CYP2D6MEN1KMT2A

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