SCHEMBL19100171

SCHEMBL19100171

Cn1nc(-c2nc(Cl)ncc2Cl)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RPS6KA5 O75582 3/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ HTR2B P41595 1/20 0.41
▸ CCR4 P51679 1/20 0.37
▸ IGF1R P08069 1/20 0.37
▸ CCNT1 O60563 2/20 0.37
▸ CDK1 P06493 2/20 0.37
▸ CCNB1 P14635 2/20 0.37
▸ CDK9 P50750 2/20 0.37
▸ CNR1 P21554 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ KDM4C Q9H3R0 1/20 0.36
▸ RPS6KA4 O75676 1/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ PDE4B Q07343 1/20 0.36
▸ PDE4C Q08493 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ PDE3B Q13370 1/20 0.36
▸ PDE3A Q14432 1/20 0.36

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
SCHEMBL19100629 0.90 RPS6KA5 (0.39) RPS6KA5HTR2AHTR2CHTR2BCCR4
SCHEMBL19100902 0.82 KDM4E (0.39) RPS6KA5HTR2AHTR2CHTR2BIGF1R
SCHEMBL17385195 0.82 IMPDH2 (0.42) HTR2AHTR2CHTR2BCCNT1CDK1
SCHEMBL29520539 0.79 PDE5A (0.39) RPS6KA5KDM4ESMN1; SMN2
SCHEMBL29520384 0.77 CCNT1 (0.52) RPS6KA5HTR2AHTR2CHTR2BCCR4
SCHEMBL17822340 0.77 CCNT1 (0.52) RPS6KA5HTR2AHTR2CHTR2BCCR4
SCHEMBL17384773 0.76 SMN1; SMN2 (0.42) KDM4ENAMPTSMN1; SMN2
SCHEMBL17373088 0.76 KDM4E (0.41) KDM4CAPLNRKDM4ENAMPTSMN1; SMN2
SCHEMBL29994241 0.75 CDK5 (0.53) RPS6KA5KDM4ESMN1; SMN2
SCHEMBL517423 0.75 CDK5 (0.53) RPS6KA5KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3399968-B1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE CS PHARMATECH LTD (KY) 2021-10-20 — — EP disclosed
US-10435388-B2 Selective inhibitors of clinically important mutants of the EGFR tyrosine kinase CS PHARMATECH LIMITED (KY) 2019-10-08 — — US disclosed
US-20190023689-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE HIGH GREAT INVESTMENT LIMITED (HK) 2019-01-24 — — US disclosed
EP-3399968-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE CS Pharmatech Limited (KY) 2018-11-14 — — EP disclosed
WO-2017120429-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE CS Pharmasciences, Inc. (US) 2017-07-13 — — WO 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-10435388-B2 Selective inhibitors of clinically important mutants of the EGFR tyrosine kinase EGFR, ERBB3, ERBB2 RPS6KA5 582/4885HTR2A 4613/4885HTR2C 4011/4885
US-20190023689-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE EGFR, ERBB3, ERBB2 RPS6KA5 582/4885HTR2A 4613/4885HTR2C 4011/4885

“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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