SCHEMBL11964262

SCHEMBL11964262

CN1CCN(c2nc(Nc3cc(-c4ccccn4)[nH]n3)nc(Sc3ccccc3)n2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 9/20 0.51
▸ NTRK1 P04629 4/20 0.51
▸ AURKB Q96GD4 5/20 0.50
▸ RIPK1 Q13546 2/20 0.50
▸ IGF1R P08069 2/20 0.40
▸ METAP1 P53582 1/20 0.38
▸ FLT3 P36888 3/20 0.37
▸ ABL1 P00519 2/20 0.37
▸ BCR P11274 2/20 0.37
▸ SRC P12931 2/20 0.37
▸ KDR P35968 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ HRH1 P35367 1/20 0.37
▸ HRH4 Q9H3N8 1/20 0.37
▸ BMPR1B O00238 1/20 0.36
▸ PLK4 O00444 1/20 0.36
▸ STK25 O00506 1/20 0.36
▸ RIOK3 O14730 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
SCHEMBL11964252 0.88 AURKA (0.61) AURKANTRK1AURKBRIPK1FLT3
SCHEMBL11964856 0.86 AURKB (0.70) AURKANTRK1AURKBRIPK1IGF1R
SCHEMBL11964247 0.86 KMT2A (0.47) AURKAAURKBIGF1RMETAP1FLT3
SCHEMBL11964267 0.85 AURKA (0.56) AURKANTRK1AURKBRIPK1FLT3
SCHEMBL11964537 0.84 AURKA (0.55) AURKANTRK1AURKBRIPK1FLT3
SCHEMBL11964266 0.84 AURKA (0.55) AURKANTRK1AURKBRIPK1FLT3
SCHEMBL11964165 0.84 FLT3 (0.56) AURKANTRK1AURKBRIPK1FLT3
SCHEMBL11964535 0.84 AURKA (0.61) AURKANTRK1AURKBRIPK1FLT3
SCHEMBL11952787 0.83 AURKA (0.50) AURKANTRK1AURKBRIPK1IGF1R
SCHEMBL11964178 0.83 AURKA (0.56) AURKANTRK1AURKBRIPK1IGF1R

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-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

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 877/4885NTRK1 994/4885AURKB 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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