SCHEMBL10294757

SCHEMBL10294757

CC(C)c1cc(Nc2nc(Sc3ccc(NC(=O)c4ccccc4)cc3)nc(C3CC3)n2)n[nH]1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AURKB Q96GD4 8/20 0.47
▸ SRC P12931 4/20 0.47
▸ GSK3B P49841 4/20 0.47
▸ AURKA O14965 5/20 0.43
▸ KDM5A P29375 1/20 0.42
▸ RIPK1 Q13546 1/20 0.42
▸ PRKAB2 O43741 4/20 0.41
▸ PRKAG1 P54619 4/20 0.41
▸ PRKAA2 P54646 4/20 0.41
▸ PRKAA1 Q13131 4/20 0.41
▸ PRKAG3 Q9UGI9 4/20 0.41
▸ PRKAG2 Q9UGJ0 4/20 0.41
▸ PRKAB1 Q9Y478 4/20 0.41
▸ CCNA2 P20248 2/20 0.41
▸ CDK2 P24941 2/20 0.41
▸ CCNA1 P78396 2/20 0.41
▸ AURKC Q9UQB9 1/20 0.41
▸ IGF1R P08069 1/20 0.39

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
SCHEMBL10294845 0.89 AURKB (0.55) AURKBSRCGSK3BAURKARIPK1
SCHEMBL10294994 0.89 AURKB (0.53) AURKBSRCGSK3BAURKARIPK1
SCHEMBL10294997 0.88 AURKB (0.46) AURKBSRCGSK3BAURKARIPK1
SCHEMBL10294838 0.88 AURKB (0.58) AURKBSRCGSK3BAURKACCNA2
SCHEMBL10294899 0.87 AURKB (0.53) AURKBSRCGSK3BAURKARIPK1
SCHEMBL10294760 0.87 AURKB (0.47) AURKBSRCGSK3BAURKARIPK1
SCHEMBL10294946 0.87 AURKB (0.58) AURKBSRCGSK3BAURKARIPK1
SCHEMBL10294933 0.86 AURKB (0.56) AURKBSRCGSK3BAURKARIPK1
SCHEMBL10295003 0.85 AURKB (0.47) AURKBSRCGSK3BAURKARIPK1
SCHEMBL10294839 0.83 AURKA (0.59) AURKBSRCAURKARIPK1PRKAA2

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-20120172361-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY, LLC (US) 2012-07-05 — — US disclosed
WO-2010144359-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS ABRAXIS BIOSCIENCE, LLC (US) 2010-12-16 — — 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 (1 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-20120172361-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CYP3A5, CYP11B2, ABCB1 AURKB 3449/4885SRC 1662/4885GSK3B 1084/4885

“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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