SCHEMBL715667

SCHEMBL715667

C[C@H](N)c1cc2cccc(Cl)c2nc1N1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
NFKB1 P19838 1/20 0.43
PNMT P11086 1/20 0.43
PIK3CG P48736 1/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 1/20 0.42
GLA P06280 1/20 0.42
PIK3C2B O00750 1/20 0.40
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CNR2 P34972 6/20 0.39
POLB P06746 1/20 0.38
ALOX15 P16050 1/20 0.38
PIK3CD O00329 1/20 0.38
LRRK2 Q5S007 1/20 0.37

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
SCHEMBL715249 0.89 HPGD (0.43) CYP1A2CYP3A4CYP2D6NFKB1PNMT
SCHEMBL715480 0.82 ATR (0.42)
SCHEMBL715481 0.82 ATR (0.42)
SCHEMBL17530846 0.81 ALDH1A1 (0.41) CYP1A2CYP3A4CYP2D6NFKB1PNMT
SCHEMBL714963 0.81 ALDH1A1 (0.41) CYP1A2CYP3A4CYP2D6NFKB1PNMT
SCHEMBL717045 0.81 PIK3CB (0.40) CYP1A2CYP3A4PIK3CGALDH1A1PIK3C2B
SCHEMBL15875816 0.81 DRD2 (0.48) ALDH1A1LMNAKDM4ECNR2
SCHEMBL17530790 0.81 DRD2 (0.48) ALDH1A1LMNAKDM4ECNR2
SCHEMBL715383 0.80 CNR2 (0.43) CNR2
SCHEMBL713497 0.80 CYP1A2 (0.38) CYP1A2CYP3A4CYP2D6NFKB1PNMT

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
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 CYP1A2 2609/4885CYP3A4 2997/4885CYP2D6 4112/4885

“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.