SCHEMBL10120561

SCHEMBL10120561

CCOc1ncnc(Nc2ccc(C#N)cc2F)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.47
FGFR1 P11362 3/20 0.44
FLT1 P17948 3/20 0.44
FLT4 P35916 3/20 0.44
KDR P35968 3/20 0.44
FGFR2 P21802 1/20 0.44
FGFR4 P22455 1/20 0.44
FGFR3 P22607 1/20 0.44
EGFR P00533 2/20 0.43
MAP2K1 Q02750 1/20 0.39
EPHB2 P29323 1/20 0.39

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
SCHEMBL15381364 0.88 GPR119 (0.48) GPR119FGFR1FLT1FLT4KDR
SCHEMBL10120672 0.86 GPR119 (0.47) GPR119FGFR1FLT1FLT4KDR
SCHEMBL10105782 0.85 GPR119 (0.50) GPR119FGFR1FLT1FLT4KDR
SCHEMBL10120557 0.85 GPR119 (0.51) GPR119FGFR1FLT1FLT4KDR
SCHEMBL15381343 0.82 GPR119 (0.54) GPR119
SCHEMBL10120507 0.79 GPR119 (0.51) GPR119FGFR1FLT1FLT4KDR
SCHEMBL10120559 0.79 GPR119 (0.51) GPR119
SCHEMBL10120519 0.78 GPR119 (0.58) GPR119FGFR1FLT1FLT4KDR
SCHEMBL10134277 0.77 GPR119 (0.49) GPR119FGFR1FLT1FLT4KDR
SCHEMBL10120569 0.77 EIF4E (0.51) GPR119FGFR1FLT1FLT4KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120040975-A1 BRIDGED BICYCLIC HETEROCYCLE DERIVATIVES AND METHODS OF USE THEREOF MERCK SHARP & DOHME CORP. 2012-02-16 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-20120040975-A1 BRIDGED BICYCLIC HETEROCYCLE DERIVATIVES AND METHODS OF USE THEREOF GPR119, BDKRB2, GLP1R GPR119 1/4885FGFR1 131/4885FLT1 850/4885

“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.