SCHEMBL27145118

SCHEMBL27145118

Oc1cc(-c2ccnc(Nc3ccccn3)n2)ccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ ALPL P05186 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ ALPI P09923 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ ALPG P10696 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ CDK4 P11802 3/20 0.48
▸ CCND1 P24385 3/20 0.48
▸ CDK1 P06493 2/20 0.48
▸ CCNB1 P14635 2/20 0.48
▸ CCNA2 P20248 2/20 0.48
▸ CDK2 P24941 2/20 0.48
▸ CCNA1 P78396 1/20 0.48
▸ PLK1 P53350 3/20 0.46
▸ MAPK13 O15264 1/20 0.46
▸ MAPK12 P53778 1/20 0.46
▸ MAPK11 Q15759 1/20 0.46

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
SCHEMBL27145130 0.86 PLK1 (0.51) NPC1MEN1KMT2APOLBGAA
SCHEMBL27116599 0.82 ABL1 (0.62) NPC1CDK1CCNB1CDK2PLK1
SCHEMBL27115673 0.82 ABL1 (0.44) NPC1CDK4CCND1CDK1CCNB1
SCHEMBL27148413 0.81 IGF1R (0.49) NPC1MEN1KMT2ACDK4CCND1
SCHEMBL27115516 0.79 SYK (0.48) PLK1
SCHEMBL27146831 0.79 SYK (0.50) CCNA2CDK2CCNA1PLK1SRC
SCHEMBL2819228 0.79 CDK4 (0.54) MEN1KMT2AALPLPOLBALPI
SCHEMBL27116075 0.78 CCNB2 (0.55) CDK4CDK1CCNB1CDK2PLK1
SCHEMBL29775098 0.77 MAPK13 (0.42) NPC1MEN1KMT2AALPLPOLB
SCHEMBL29557417 0.77 ABL1 (0.72) NPC1CDK4CCND1CDK1CCNB1

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
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
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