SCHEMBL29974176

SCHEMBL29974176

COc1cc(N(C)CCN(C)C)c(N)cc1Nc1nccc(-c2c[nH]c3ccccc23)n1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.74
KCNH2 Q12809 3/20 0.74
FLT3 P36888 1/20 0.63
MKNK1 Q9BUB5 1/20 0.63
MKNK2 Q9HBH9 1/20 0.63
IGF1R P08069 1/20 0.57
MLNR O43193 1/20 0.55
KDM1A O60341 1/20 0.55
ABCB11 O95342 1/20 0.55
ERBB2 P04626 1/20 0.55
INSR P06213 1/20 0.55
CHRM2 P08172 1/20 0.55
HTR1A P08908 1/20 0.55
ADORA3 P0DMS8 1/20 0.55
DRD2 P14416 1/20 0.55
NQO2 P16083 1/20 0.55
ADRA2C P18825 1/20 0.55
DRD1 P21728 1/20 0.55
ERBB3 P21860 1/20 0.55
SLC6A2 P23975 1/20 0.55

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
SCHEMBL14670821 1.00 EGFR (0.74) EGFRKCNH2FLT3MKNK1MKNK2
SCHEMBL30956845 0.90 EGFR (0.62) EGFRKCNH2FLT3MKNK1MKNK2
SCHEMBL17553569 0.90 CCNB2 (0.61) EGFRKCNH2MLNRKDM1AABCB11
SCHEMBL17831507 0.88 EGFR (0.63) EGFRKCNH2FLT3MKNK1MKNK2
SCHEMBL17553822 0.88 EGFR (0.58) EGFRKCNH2MLNRKDM1AABCB11
SCHEMBL22510248 0.88 EGFR (0.62) EGFRKCNH2FLT3MKNK1MKNK2
SCHEMBL20644828 0.87 EGFR (0.60) EGFRKCNH2FLT3MKNK1MKNK2
SCHEMBL22510252 0.87 EGFR (0.63) EGFRKCNH2IGF1RMLNRKDM1A
SCHEMBL22510250 0.87 EGFR (0.63) EGFRKCNH2IGF1RMLNRKDM1A
SCHEMBL22753296 0.86 EGFR (0.86) EGFRKCNH2IGF1RMLNRKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4119551-A1 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS Astrazeneca AB (SE) 2023-01-18 EP claimed
US-20240425476-A1 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2024-12-26 US disclosed
US-20240182441-A1 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2024-06-06 US disclosed
EP-4119551-A1 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS Astrazeneca AB (SE) 2023-01-18 EP disclosed
US-11524951-B2 2-(2,4,5-substituted-anilino)pyrimidine compounds ASTRAZENECA AB (SE) 2022-12-13 US disclosed
EP-4086246-A1 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS AS EGFR MODULATORS AstraZeneca AB (SE) 2022-11-09 EP 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 (3 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-20240425476-A1 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS EGFR, ERBB2, ERBB3 EGFR 1/4885KCNH2 2959/4885FLT3 21/4885
US-11524951-B2 2-(2,4,5-substituted-anilino)pyrimidine compounds EGFR, ERBB2, ERBB3 EGFR 1/4885KCNH2 2959/4885FLT3 21/4885
US-20240182441-A1 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS EGFR, ERBB2, ERBB3 EGFR 1/4885KCNH2 2959/4885FLT3 21/4885

“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.