SCHEMBL27115671

SCHEMBL27115671

COc1ccc(-c2ccnc(Nc3cccc(F)c3)n2)nc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 6/20 0.63
▸ PIK3CA P42336 5/20 0.63
▸ PIK3CB P42338 5/20 0.59
▸ CDK5 Q00535 2/20 0.56
▸ CDK2 P24941 3/20 0.55
▸ CDK4 P11802 2/20 0.55
▸ EGFR P00533 1/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ CDK5R1 Q15078 1/20 0.50
▸ GSK3B P49841 2/20 0.49
▸ DYRK1A Q13627 1/20 0.49
▸ SYK P43405 5/20 0.48
▸ ABL1 P00519 1/20 0.48
▸ BCR P11274 1/20 0.48
▸ CDC7 O00311 1/20 0.46
▸ CDK19 Q9BWU1 1/20 0.46
▸ IGF1R P08069 1/20 0.45

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
SCHEMBL4736185 0.86 PIK3CG (0.80) PIK3CGPIK3CAPIK3CBCDK5CDK2
SCHEMBL27115897 0.86 PIK3CG (0.69) PIK3CGPIK3CAPIK3CBCDK5CDK2
SCHEMBL4735972 0.82 PIK3CG (0.78) PIK3CGPIK3CAPIK3CBCDK5CDK2
SCHEMBL27116069 0.82 PIK3CG (0.67) PIK3CGPIK3CAPIK3CBCDK5CDK2
SCHEMBL27116528 0.80 PIK3CG (0.64) PIK3CGPIK3CAPIK3CBCDK5CDK2
SCHEMBL27116179 0.79 PIK3CG (0.66) PIK3CGPIK3CAPIK3CBCDK5CDK2
SCHEMBL7469928 0.79 ABL1 (0.64) PIK3CGPIK3CACDK5CDK2CDK4
SCHEMBL20004013 0.77 PIK3CG (0.56) PIK3CGPIK3CAPIK3CBCDK5CDK2
SCHEMBL27115762 0.77 CDK2 (0.58) PIK3CGPIK3CAPIK3CBCDK5CDK2
SCHEMBL27114966 0.77 PIK3CA (0.49) PIK3CGPIK3CAPIK3CBCDK5CDK2

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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