SCHEMBL27115445

SCHEMBL27115445

COc1cc(-c2ccnc(Nc3cccc(C)c3)n2)ccn1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 6/20 0.66
▸ PIK3CA P42336 5/20 0.66
▸ ABL1 P00519 4/20 0.66
▸ BCR P11274 4/20 0.66
▸ CDK2 P24941 2/20 0.60
▸ CDK1 P06493 2/20 0.60
▸ SMG1 Q96Q15 2/20 0.60
▸ PIK3CB P42338 4/20 0.59
▸ SRC P12931 3/20 0.58
▸ ZAP70 P43403 1/20 0.58
▸ SYK P43405 1/20 0.58
▸ CCNB2 O95067 1/20 0.57
▸ RET P07949 1/20 0.57
▸ CCNB1 P14635 1/20 0.57
▸ CCNB3 Q8WWL7 1/20 0.57
▸ MAPT P10636 1/20 0.56
▸ CDK5 Q00535 2/20 0.56
▸ MEN1 O00255 1/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ RAB9A P51151 1/20 0.53

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
SCHEMBL27115896 0.89 PIK3CG (0.76) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL27116600 0.88 ABL1 (0.57) PIK3CGPIK3CAABL1BCRSMG1
SCHEMBL27116528 0.88 PIK3CG (0.64) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL5733563 0.88 MAPT (0.72) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL27115339 0.86 PIK3CG (0.55) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL2331086 0.86 PIK3CG (0.70) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL2322043 0.86 PIK3CG (0.70) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL27115892 0.85 ABL1 (0.59) PIK3CGPIK3CAABL1BCRPIK3CB
SCHEMBL27115444 0.85 PIK3CA (0.69) PIK3CGPIK3CAABL1BCRCDK2
Hydrochloric Acid SCHEMBL16496538 0.85 PIK3CG (0.69) PIK3CGPIK3CAABL1BCRCDK2

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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