SCHEMBL715798

SCHEMBL715798

CNc1ncnc(NC(C)c2cc3cccc(Cl)c3nc2N2CCN(CC(=O)O)CC2)n1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.40
LMNA P02545 1/20 0.36
WEE1 P30291 1/20 0.35
PIK3CD O00329 4/20 0.35
NR1H4 Q96RI1 2/20 0.34
CNR2 P34972 2/20 0.34
CNR1 P21554 1/20 0.34
KDR P35968 1/20 0.33
FAAH O00519 1/20 0.33
SCN9A Q15858 1/20 0.33
GPR6 P46095 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL715797 1.00 TNF (0.40) TNFLMNAWEE1PIK3CDNR1H4
SCHEMBL715573 0.92 TNF (0.40) TNFLMNAWEE1PIK3CDCNR2
SCHEMBL17530866 0.92 TNF (0.40) TNFLMNAWEE1PIK3CDCNR2
SCHEMBL715740 0.88 LMNA (0.37) LMNAPIK3CDCNR2KDRKDM4E
SCHEMBL715739 0.88 LMNA (0.37) LMNAPIK3CDCNR2KDRKDM4E
SCHEMBL718468 0.83 PIK3R2 (0.40) TNFWEE1PIK3CDKDRALDH1A1
SCHEMBL715848 0.83 PIK3R2 (0.40) TNFWEE1PIK3CDKDRALDH1A1
SCHEMBL715149 0.83 PIK3CD (0.47) TNFLMNAPIK3CD
SCHEMBL715148 0.83 PIK3CD (0.47) TNFLMNAPIK3CD
SCHEMBL14480865 0.82 PIK3CD (0.45) TNFPIK3CDGPR6

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 TNF 574/4885LMNA 4722/4885WEE1 128/4885

“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.