SCHEMBL10120519

SCHEMBL10120519

COc1ncnc(Nc2ccc(C#N)cc2F)c1C

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.58
KDR P35968 5/20 0.48
FLT1 P17948 5/20 0.48
FGFR1 P11362 4/20 0.48
FLT4 P35916 3/20 0.48
FGFR2 P21802 1/20 0.48
FGFR4 P22455 1/20 0.48
FGFR3 P22607 1/20 0.48
EGFR P00533 2/20 0.47
RET P07949 1/20 0.42
KIF5B P33176 1/20 0.42
EPHB2 P29323 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41

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
SCHEMBL10120507 0.89 GPR119 (0.51) GPR119KDRFLT1FGFR1FLT4
SCHEMBL10120456 0.87 GPR119 (0.55) GPR119KDRFLT1FGFR1FLT4
SCHEMBL15381364 0.87 GPR119 (0.48) GPR119KDRFLT1FGFR1FLT4
SCHEMBL12319936 0.85 GPR119 (0.58) GPR119EGFR
SCHEMBL5048756 0.82 GPR119 (0.67) GPR119KDRFLT1FGFR1FLT4
SCHEMBL10120557 0.81 GPR119 (0.51) GPR119KDRFLT1FGFR1FLT4
SCHEMBL14668800 0.81 GPR119 (0.71) GPR119
SCHEMBL10105799 0.81 GPR119 (0.53) GPR119KDRFLT1FGFR1FLT4
SCHEMBL28374004 0.80 GPR119 (0.47) GPR119KDRFLT1FGFR1FLT4
SCHEMBL10120569 0.80 EIF4E (0.51) GPR119KDRFLT1FGFR1FLT4

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
US-8907095-B2 Bicyclic heterocycle derivatives and their use as modulators of the activity of GPR119 MERCK SHARP & DOHME CORP. (US) 2014-12-09 US disclosed
US-20120040975-A1 BRIDGED BICYCLIC HETEROCYCLE DERIVATIVES AND METHODS OF USE THEREOF MERCK SHARP & DOHME CORP. 2012-02-16 US disclosed
US-20110212938-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND THEIR USE AS MODULATORS OF THE ACTIVITY OF GPR119 SCHERING CORPORATION 2011-09-01 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 (2 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-20120040975-A1 BRIDGED BICYCLIC HETEROCYCLE DERIVATIVES AND METHODS OF USE THEREOF GPR119, BDKRB2, GLP1R GPR119 1/4885KDR 464/4885FLT1 850/4885
US-20110212938-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND THEIR USE AS MODULATORS OF THE ACTIVITY OF GPR119 GPR119, GPR88, GPR180 GPR119 1/4885KDR 578/4885FLT1 1409/4885

“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.