SCHEMBL31078469

SCHEMBL31078469

Cc1cc(-c2cc(Br)c3c(N)ncnn23)ccn1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 9/20 0.48
MAP4K4 O95819 2/20 0.44
CSNK2A2 P19784 8/20 0.42
CSNK2A1 P68400 8/20 0.42
ACVRL1 P37023 1/20 0.39

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
SCHEMBL5074903 0.84 PIK3CD (0.47) PIK3CDCSNK2A2CSNK2A1
SCHEMBL31078253 0.83 PIK3CD (0.54) PIK3CDCSNK2A2CSNK2A1
SCHEMBL5077184 0.78 PIK3CD (0.62) PIK3CDCSNK2A2CSNK2A1
SCHEMBL14327056 0.75 CSNK2A2 (0.43) PIK3CDCSNK2A2CSNK2A1
SCHEMBL5077780 0.74 PIK3CD (0.55) PIK3CDCSNK2A2CSNK2A1ACVRL1
SCHEMBL14327060 0.74 PIK3CD (0.58) PIK3CD
SCHEMBL5141113 0.74 PIK3CD (0.55) PIK3CDCSNK2A2CSNK2A1ACVRL1
SCHEMBL19690039 0.73 PIK3CD (0.61) PIK3CDCSNK2A2CSNK2A1
SCHEMBL14888138 0.73 PIK3CD (0.58) PIK3CDACVRL1
SCHEMBL64680 0.73 ALDH1A1 (0.42) PIK3CDACVRL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4665733-A1 AMINO-SUBSTITUTED PYRROLOTRIAZINE DERIVATIVES AS INHIBITORS OF SGK1 Bristol-Myers Squibb Company (US) 2025-12-24 EP disclosed
WO-2024173323-A1 AMINO-SUBSTITUTED PYRROLOTRIAZINE DERIVATIVES AS INHIBITORS OF SGK1 BRISTOL-MYERS SQUIBB COMPANY (US) 2024-08-22 WO disclosed