SCHEMBL15416610

SCHEMBL15416610

CC(C)(C)OC(=O)N1CCC(n2cc(-c3cnc(-c4cccc(-c5cnn(C(=O)OC(C)(C)C)c5)c4)nc3)cn2)CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.53
HPGDS O60760 2/20 0.47
IRAK1 P51617 1/20 0.46
TTK P33981 2/20 0.46
FGFR1 P11362 2/20 0.46
FGFR2 P21802 2/20 0.46
FGFR4 P22455 2/20 0.46
FGFR3 P22607 2/20 0.46
KDR P35968 2/20 0.46
FLT3 P36888 2/20 0.46
TNK2 Q07912 1/20 0.46
GPR119 Q8TDV5 3/20 0.46
ROCK2 O75116 1/20 0.44
LIPC P11150 1/20 0.43
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
RIPK2 O43353 1/20 0.43

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
SCHEMBL20280701 0.92 MET (0.52) METHPGDSIRAK1TTKFGFR1
SCHEMBL15431560 0.92 GPR119 (0.55) METHPGDSIRAK1TTKFGFR1
SCHEMBL16899750 0.91 MET (0.51) METHPGDSIRAK1TTKFGFR1
SCHEMBL16907836 0.91 MET (0.51) METHPGDSIRAK1TTKFGFR1
SCHEMBL15416687 0.90 MET (0.51) METHPGDSIRAK1TTKFGFR1
SCHEMBL15415993 0.90 GPR119 (0.54) METHPGDSIRAK1TTKFGFR1
SCHEMBL16899801 0.89 MET (0.51) METHPGDSIRAK1TTKFGFR1
SCHEMBL15431641 0.89 GPR119 (0.52) METHPGDSIRAK1TTKFGFR1
SCHEMBL15416250 0.89 MET (0.49) METHPGDSIRAK1TTKFGFR1
SCHEMBL15416081 0.88 MET (0.54) METHPGDSIRAK1TTKFGFR1

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-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-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

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 2807/4885HPGDS 143/4885IRAK1 117/4885

“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.