SCHEMBL15416687

SCHEMBL15416687

CC(C)(C)OC(=O)N1CCC(n2cc(-c3cnc(-c4cccc(-c5ccncc5)c4)nc3)cn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.51
GPR119 Q8TDV5 7/20 0.50
TNK2 Q07912 1/20 0.47
HPGDS O60760 2/20 0.47
IRAK1 P51617 1/20 0.46
TTK P33981 2/20 0.46
FGFR1 P11362 1/20 0.46
FGFR2 P21802 1/20 0.46
FGFR4 P22455 1/20 0.46
FGFR3 P22607 1/20 0.46
KDR P35968 1/20 0.46
FLT3 P36888 1/20 0.46
CCNC P24863 1/20 0.45
CDK8 P49336 1/20 0.45
USP30 Q70CQ3 1/20 0.44

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
SCHEMBL15415993 0.92 GPR119 (0.54) METGPR119TNK2HPGDSIRAK1
SCHEMBL20280701 0.91 MET (0.52) METGPR119TNK2HPGDSIRAK1
SCHEMBL15431560 0.91 GPR119 (0.55) METGPR119TNK2HPGDSIRAK1
SCHEMBL16899750 0.90 MET (0.51) METGPR119TNK2HPGDSIRAK1
SCHEMBL16907836 0.90 MET (0.51) METGPR119TNK2HPGDSIRAK1
SCHEMBL15416610 0.90 MET (0.53) METGPR119TNK2HPGDSIRAK1
SCHEMBL16899801 0.88 MET (0.51) METGPR119TNK2HPGDSIRAK1
SCHEMBL15416250 0.88 MET (0.49) METGPR119TNK2HPGDSIRAK1
SCHEMBL15431641 0.88 GPR119 (0.52) METGPR119TNK2HPGDSIRAK1
SCHEMBL15416081 0.88 MET (0.54) METGPR119TNK2HPGDSIRAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2872501-B1 PYRIMIDINE PYRAZOLYL DERIVATIVES ARES TRADING SA (CH) 2016-06-01 EP disclosed
EP-2872501-B1 PYRIMIDINE PYRAZOLYL DERIVATIVES ARES TRADING SA (CH) 2016-06-01 EP disclosed
US-9216991-B2 Pyrimidine pyrazolyl derivatives ARES TRADING S.A. (CH) 2015-12-22 US disclosed
US-9216991-B2 Pyrimidine pyrazolyl derivatives ARES TRADING S.A. (CH) 2015-12-22 US disclosed
US-9216991-B2 Pyrimidine pyrazolyl derivatives ARES TRADING S.A. (CH) 2015-12-22 US disclosed
US-20150141396-A1 PYRIMIDINE PYRAZOLYL DERIVATIVES ARES TRADING S.A. (CH) 2015-05-21 US disclosed
US-20150141396-A1 PYRIMIDINE PYRAZOLYL DERIVATIVES ARES TRADING S.A. (CH) 2015-05-21 US disclosed
US-20150141396-A1 PYRIMIDINE PYRAZOLYL DERIVATIVES ARES TRADING S.A. (CH) 2015-05-21 US disclosed
EP-2872501-A1 PYRIMIDINE PYRAZOLYL DERIVATIVES Ares Trading S.A. (CH) 2015-05-20 EP disclosed
WO-2014008992-A1 PYRIMIDINE PYRAZOLYL DERIVATIVES ARES TRADING S.A. (CH) 2014-01-16 WO disclosed
WO-2014008992-A1 PYRIMIDINE PYRAZOLYL DERIVATIVES ARES TRADING S.A. (CH) 2014-01-16 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-20150141396-A1 PYRIMIDINE PYRAZOLYL DERIVATIVES DPYD, TYMS, DHFR MET 2807/4885GPR119 2437/4885TNK2 1436/4885

“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.