SCHEMBL27115896

SCHEMBL27115896

COc1cccc(Nc2nccc(-c3ccnc(OC)c3)n2)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 6/20 0.76
▸ PIK3CA P42336 5/20 0.76
▸ PIK3CB P42338 4/20 0.76
▸ MTOR P42345 1/20 0.64
▸ SMG1 Q96Q15 1/20 0.64
▸ EGFR P00533 1/20 0.63
▸ GSK3B P49841 4/20 0.61
▸ CDK2 P24941 3/20 0.61
▸ CDK5 Q00535 3/20 0.61
▸ DYRK1A Q13627 2/20 0.59
▸ CDK4 P11802 1/20 0.59
▸ MEN1 O00255 1/20 0.58
▸ NPC1 O15118 1/20 0.58
▸ RAB9A P51151 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ CDK5R1 Q15078 1/20 0.58
▸ MAPT P10636 1/20 0.55
▸ ABL1 P00519 2/20 0.54
▸ BCR P11274 2/20 0.54
▸ SYK P43405 2/20 0.54

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
SCHEMBL27116598 0.90 PIK3CG (0.83) PIK3CGPIK3CAPIK3CBMTORSMG1
SCHEMBL27115445 0.89 PIK3CG (0.66) PIK3CGPIK3CAPIK3CBMTORSMG1
SCHEMBL27115034 0.89 PIK3CG (0.60) PIK3CGPIK3CAPIK3CBMTORSMG1
SCHEMBL27114961 0.88 PIK3CG (0.59) PIK3CGPIK3CAPIK3CBMTORSMG1
SCHEMBL2324992 0.88 PIK3CG (0.76) PIK3CGPIK3CAPIK3CBMTORSMG1
SCHEMBL8489648 0.88 PIK3CG (0.76) PIK3CGPIK3CAPIK3CBMTORSMG1
SCHEMBL7464195 0.88 PIK3CG (0.83) PIK3CGPIK3CAPIK3CBMTORSMG1
SCHEMBL27116600 0.87 ABL1 (0.57) PIK3CGPIK3CAPIK3CBSMG1EGFR
SCHEMBL5999205 0.87 PIK3CG (0.77) PIK3CGPIK3CAPIK3CBMTORSMG1
SCHEMBL5733563 0.87 MAPT (0.72) PIK3CGPIK3CAPIK3CBMTORSMG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024044757-A1 AMINOPYRIMIDINE AND AMINOTRIAZINE DERIVATIVES AS MYC PROTEIN MODULATORS Sanford Burnham Prebys Medical Discovery Institute (US) 2024-02-29 — — WO claimed
WO-2024044757-A1 AMINOPYRIMIDINE AND AMINOTRIAZINE DERIVATIVES AS MYC PROTEIN MODULATORS Sanford Burnham Prebys Medical Discovery Institute (US) 2024-02-29 — — WO disclosed
WO-2024044757-A1 AMINOPYRIMIDINE AND AMINOTRIAZINE DERIVATIVES AS MYC PROTEIN MODULATORS Sanford Burnham Prebys Medical Discovery Institute (US) 2024-02-29 — — WO disclosed
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