SCHEMBL11964155

SCHEMBL11964155

CN1CCN(c2nc(Nc3cc(-c4ccco4)[nH]n3)nc(Sc3cccc(N)c3)n2)CC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 5/20 0.45
▸ RIPK1 Q13546 1/20 0.45
▸ AURKB Q96GD4 1/20 0.45
▸ NTRK1 P04629 3/20 0.44
▸ IGF1R P08069 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ FLT3 P36888 1/20 0.38
▸ EGFR P00533 1/20 0.37
▸ PDPK1 O15530 1/20 0.35

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
SCHEMBL11952788 0.92 AURKA (0.50) AURKARIPK1AURKBNTRK1IGF1R
SCHEMBL11952787 0.92 AURKA (0.50) AURKARIPK1AURKBNTRK1IGF1R
SCHEMBL11952793 0.91 AURKA (0.45) AURKARIPK1AURKBNTRK1IGF1R
SCHEMBL11952795 0.88 AURKA (0.52) AURKARIPK1AURKBNTRK1IGF1R
SCHEMBL11952797 0.88 AURKA (0.46) AURKARIPK1AURKBNTRK1IGF1R
SCHEMBL11952798 0.88 AURKA (0.47) AURKARIPK1AURKBNTRK1IGF1R
SCHEMBL11952792 0.88 AURKA (0.49) AURKARIPK1AURKBNTRK1IGF1R
SCHEMBL11952791 0.88 AURKA (0.51) AURKARIPK1AURKBNTRK1IGF1R
SCHEMBL11964288 0.86 AURKA (0.56) AURKARIPK1AURKBNTRK1KDM4E
SCHEMBL11964167 0.86 AURKA (0.48) AURKARIPK1AURKBNTRK1IGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9078902-B2 Triazine derivatives and their therapeutical applications NANTBIOSCIENCE, INC. (US) 2015-07-14 — — US disclosed
US-20120196860-A1 Triazine derivatives and their therapeutical applications CALIFORNIA CAPITAL EQUITY, LLC (US) 2012-08-02 — — US disclosed
WO-2010144550-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-20120196860-A1 Triazine derivatives and their therapeutical applications MAP3K2, MAP3K5, MAP4K2 AURKA 877/4885RIPK1 367/4885AURKB 756/4885

“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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