SCHEMBL23294110

SCHEMBL23294110

COc1cc(N2CCN(C)CC2)c(Nc2ncc(C)c(-c3c[nH]c4ccccc34)n2)cc1N

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 8/20 0.61
▸ IGF1R P08069 3/20 0.54
▸ KCNH2 Q12809 1/20 0.54
▸ JAK1 P23458 3/20 0.53
▸ JAK2 O60674 2/20 0.53
▸ ALK Q9UM73 1/20 0.52
▸ CDK7 P50613 2/20 0.45
▸ CCNH P51946 2/20 0.45
▸ MNAT1 P51948 2/20 0.45
▸ CCNT1 O60563 1/20 0.45
▸ CCNK O75909 1/20 0.45
▸ CDK9 P50750 1/20 0.45
▸ CDK12 Q9NYV4 1/20 0.45
▸ CDK2 P24941 2/20 0.45
▸ DYRK1B Q9Y463 2/20 0.45
▸ CDK1 P06493 1/20 0.45
▸ KDR P35968 1/20 0.45
▸ TNK2 Q07912 2/20 0.43
▸ JUN P05412 1/20 0.43
▸ MAPK8 P45983 1/20 0.43

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
SCHEMBL29974991 0.94 EGFR (0.63) EGFRIGF1RKCNH2JAK1JAK2
SCHEMBL14663383 0.94 EGFR (0.63) EGFRIGF1RKCNH2JAK1JAK2
SCHEMBL14663454 0.91 EGFR (0.72) EGFRIGF1RKCNH2ALKCDK7
SCHEMBL14663350 0.85 EGFR (0.72) EGFRIGF1RKCNH2CDK7CCNH
SCHEMBL30998031 0.85 EGFR (0.72) EGFRIGF1RKCNH2CDK7CCNH
SCHEMBL30956842 0.85 ALK (0.57) EGFRIGF1RKCNH2JAK1JAK2
SCHEMBL29232072 0.85 ALK (0.57) EGFRIGF1RKCNH2JAK1JAK2
SCHEMBL14663439 0.85 EGFR (0.74) EGFRIGF1RKCNH2ALKCDK7
SCHEMBL29974570 0.85 EGFR (0.74) EGFRIGF1RKCNH2ALKCDK7
SCHEMBL14718523 0.84 EGFR (0.61) EGFRIGF1RKCNH2JAK1JAK2

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
US-11524951-B2 2-(2,4,5-substituted-anilino)pyrimidine compounds ASTRAZENECA AB (SE) 2022-12-13 — — US disclosed
US-20210130318-A1 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2021-05-06 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210130318-A1 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS EGFR, ERBB2, ERBB3 EGFR 1/4885IGF1R 253/4885KCNH2 2959/4885
US-11524951-B2 2-(2,4,5-substituted-anilino)pyrimidine compounds EGFR, ERBB2, ERBB3 EGFR 1/4885IGF1R 253/4885KCNH2 2959/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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