SCHEMBL10156571

SCHEMBL10156571

CSc1nc(Cl)c(C(N)=O)c(Nc2cccc(C(=O)N(C)C)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CAMK1D Q8IU85 1/20 0.43
TP53 P04637 1/20 0.43
PTK2 Q05397 1/20 0.39
NEK2 P51955 1/20 0.39
PPARG P37231 2/20 0.39
TGFBR1 P36897 1/20 0.38
EPHB4 P54760 2/20 0.38
MAPT P10636 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
CSNK2A1 P68400 1/20 0.37
PDE4B Q07343 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37

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
SCHEMBL10127040 0.90 TP53 (0.46) TP53PPARGTGFBR1
SCHEMBL10127045 0.88 MAPT (0.45) TP53PPARGTGFBR1MAPTCA1
SCHEMBL16305326 0.86 CSNK2A1 (0.44) TP53PPARGCSNK2A1
SCHEMBL17069444 0.84 LMNA (0.47) PPARGMAPT
SCHEMBL10127101 0.82 CAMK1D (0.47) CAMK1D
SCHEMBL10156677 0.82 CCNB2 (0.45) MAPTCA1CA2CA7
SCHEMBL282561 0.80 ALK (0.46) CAMK1DPTK2NEK2PPARGMAPT
SCHEMBL10127055 0.80 CA1 (0.52) PTK2NEK2MAPTCSNK2A1CA1
SCHEMBL17340288 0.80 CA1 (0.47) TP53PTK2NEK2PPARGMAPT
SCHEMBL10127090 0.79 CA1 (0.48) PPARGMAPTPDE4BCA1CA2

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
US-9487491-B2 Diamino heterocyclic carboxamide compound ASTELLAS PHARMA INC. (JP) 2016-11-08 US disclosed
EP-2428508-B9 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND ASTELLAS PHARMA INC (JP) 2016-04-20 EP disclosed
EP-2428508-B1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND ASTELLAS PHARMA INC (JP) 2015-12-16 EP disclosed
US-8969336-B2 Diamino heterocyclic carboxamide compound ASTELLAS PHARMA INC. (JP) 2015-03-03 US disclosed
US-20140371196-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2014-12-18 US disclosed
US-20120040968-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND WATERS TECHNOLOGIES CORPORATION (US) 2012-02-16 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-20140371196-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND EML4, ALK, ERBB4 CAMK1D 1430/4885TP53 1763/4885PTK2 1402/4885
US-20120040968-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND EML4, ALK, ERBB4 CAMK1D 1430/4885TP53 1763/4885PTK2 1402/4885

“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.