SCHEMBL31489247

SCHEMBL31489247

C[C@@H](c1ccc(C#N)cc1)n1cc(-c2cccc(-c3ccn4nc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)nc4c3)c2F)cn1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 8/20 0.38
JAK2 O60674 1/20 0.32
TYK2 P29597 1/20 0.32
PGGT1B P53609 1/20 0.31
BRD4 O60885 3/20 0.31
EGLN2 Q96KS0 2/20 0.30
EP300 Q09472 5/20 0.30
RET P07949 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
SCHEMBL31489497 0.90 CREBBP (0.35) CREBBPJAK2BRD4
SCHEMBL31489736 0.87 CREBBP (0.38) CREBBPJAK2BRD4
SCHEMBL31489529 0.87 CREBBP (0.38) CREBBPJAK2BRD4
SCHEMBL31489789 0.84 RIPK1 (0.33) CREBBP
SCHEMBL31489468 0.84 CREBBP (0.33) CREBBPBRD4
SCHEMBL31489543 0.84 RIPK1 (0.33) CREBBP
SCHEMBL31489700 0.84 CREBBP (0.33) CREBBPBRD4
SCHEMBL31489310 0.83 TDP2 (0.32) JAK2
SCHEMBL31489201 0.82 RIPK1 (0.35) CREBBP
SCHEMBL31489515 0.82 RIPK1 (0.35) CREBBP

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