SCHEMBL10107875

SCHEMBL10107875

CCCc1cnc(N2CC3COCC(C2)C3Oc2nccc(Nc3ccc(S(C)(=O)=O)cc3F)c2F)nc1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.47
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL10107942 0.89 GPR119 (0.40) GPR119
SCHEMBL10107879 0.89 GPR119 (0.42) GPR119
SCHEMBL10107950 0.89 GPR119 (0.40) GPR119
SCHEMBL10107957 0.87 GPR119 (0.46) GPR119
SCHEMBL10107967 0.80 GPR119 (0.38) GPR119
SCHEMBL10107024 0.80 GPR119 (0.52) GPR119
SCHEMBL10107012 0.79 GPR119 (0.50) GPR119
SCHEMBL10107433 0.79 GPR119 (0.54) GPR119
SCHEMBL10107026 0.78 GPR119 (0.64) GPR119
SCHEMBL10121131 0.78 GPR119 (0.54) GPR119

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 1/4885KDM4E 3379/4885NPC1 751/4885

“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.