SCHEMBL17645263

SCHEMBL17645263

C[Si](C)(C)CCOCn1cc(Oc2ccnc(Cl)c2)c(-c2ccccn2)n1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 12/20 0.34
MAPK14 Q16539 1/20 0.34
F11 P03951 1/20 0.32
DGAT1 O75907 1/20 0.31
PPARG P37231 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP19A1 P11511 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
F2 P00734 1/20 0.31
PTGS2 P35354 1/20 0.31

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
SCHEMBL18722910 0.88 TGFBR1 (0.34) TGFBR1MAPK14PPARGCYP1A2CYP2D6
SCHEMBL17682037 0.88 TGFBR1 (0.34) TGFBR1MAPK14PPARGCYP1A2CYP2D6
SCHEMBL17645213 0.79 TGFBR1 (0.37) TGFBR1MAPK14F2
SCHEMBL17645372 0.77 TGFBR1 (0.49) TGFBR1
SCHEMBL30725992 0.77 KDM4E (0.38) TGFBR1MAPK14DGAT1CYP1A2CYP2D6
SCHEMBL17645163 0.76 TGFBR1 (0.37) TGFBR1MAPK14PTGS2
SCHEMBL31074732 0.76 CYP1A2 (0.35) TGFBR1MAPK14DGAT1CYP1A2CYP2D6
SCHEMBL28408249 0.76 TGFBR1 (0.46) TGFBR1
SCHEMBL17645224 0.74 TGFBR1 (0.37) TGFBR1MAPK14PTGS2
SCHEMBL17645375 0.72 TGFBR1 (0.45) TGFBR1MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3204377-B1 AMINOPYRIDYLOXYPYRAZOLE COMPOUNDS LILLY CO ELI (US) 2018-09-26 EP disclosed
US-9617243-B2 Aminopyridyloxypyrazole compounds ELI LILLY AND COMPANY (US) 2017-04-11 US disclosed
US-9617243-B2 Aminopyridyloxypyrazole compounds ELI LILLY AND COMPANY (US) 2017-04-11 US disclosed
US-9617243-B2 Aminopyridyloxypyrazole compounds ELI LILLY AND COMPANY (US) 2017-04-11 US disclosed
US-20160096823-A1 AMINOPYRIDYLOXYPYRAZOLE COMPOUNDS LILLY CO ELI (US) 2016-04-07 US disclosed
US-20160096823-A1 AMINOPYRIDYLOXYPYRAZOLE COMPOUNDS LILLY CO ELI (US) 2016-04-07 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-20160096823-A1 AMINOPYRIDYLOXYPYRAZOLE COMPOUNDS TGFBR1, TGFBR2, PDGFRB TGFBR1 1/4885MAPK14 1182/4885F11 1674/4885

“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.