SCHEMBL713285

SCHEMBL713285

Cc1c(F)ccc2cc([C@H](C)Nc3ncnc(N)n3)c(N3CCN(C(=O)CO)CC3)nc12

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 2/20 0.36
KCNH2 Q12809 1/20 0.36
OPRK1 P41145 2/20 0.35
PIK3CD O00329 7/20 0.35
KIT P10721 5/20 0.34
ALK Q9UM73 2/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
CDK4 P11802 1/20 0.32
CDK6 Q00534 1/20 0.32
SYK P43405 1/20 0.32

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
SCHEMBL713286 1.00 CDK2 (0.36) CDK2KCNH2OPRK1PIK3CDKIT
SCHEMBL17530794 0.91 KIT (0.35) OPRK1PIK3CDKIT
SCHEMBL715495 0.91 KIT (0.35) OPRK1PIK3CDKIT
SCHEMBL17530855 0.85 OPRK1 (0.33) OPRK1KIT
SCHEMBL715482 0.84 OPRK1 (0.39) OPRK1
SCHEMBL17530784 0.84 CDK2 (0.35) CDK2KCNH2OPRK1PIK3CDKIT
SCHEMBL715483 0.84 OPRK1 (0.39) OPRK1
SCHEMBL713436 0.80 AKT1 (0.42) OPRK1PIK3CA
SCHEMBL713435 0.80 AKT1 (0.42) OPRK1PIK3CA
SCHEMBL15875820 0.79 SOS1 (0.38) OPRK1ALKPIK3CA

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-2403847-B1 TRIAZINE DERIVATIVES AS KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-03-02 EP claimed
US-8785628-B2 Triazine derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2014-07-22 US claimed
EP-2403847-B1 TRIAZINE DERIVATIVES AS KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-03-02 EP disclosed
US-8785628-B2 Triazine derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2014-07-22 US disclosed
US-20120053167-A1 Triazine Derivatives as Kinase Inhibitors UCB PHARMA, S.A. (BE) 2012-03-01 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-20120053167-A1 Triazine Derivatives as Kinase Inhibitors MAP3K15, PI4KA, MAP3K20 CDK2 220/4885KCNH2 848/4885OPRK1 416/4885

“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.