SCHEMBL149552

SCHEMBL149552

CC(C)c1noc(N2CCC(C(C)CCOc3cnc(N4CC[C@H](c5cc(F)ccc5F)[C@@H](NC(=O)OC(C)(C)C)C4)nc3)CC2)n1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.38
KCNH2 Q12809 3/20 0.38
NTRK1 P04629 5/20 0.36
GPR183 P32249 1/20 0.35
RET P07949 4/20 0.32

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
SCHEMBL121467 1.00 GPR119 (0.38) GPR119KCNH2NTRK1GPR183RET
SCHEMBL149963 0.96 GPR119 (0.38) GPR119KCNH2NTRK1GPR183RET
SCHEMBL149964 0.96 GPR119 (0.38) GPR119KCNH2NTRK1GPR183RET
SCHEMBL149962 0.96 GPR119 (0.38) GPR119KCNH2NTRK1GPR183RET
SCHEMBL147233 0.92 GPR119 (0.39) GPR119KCNH2NTRK1GPR183
SCHEMBL149138 0.91 GPR119 (0.38) GPR119KCNH2GPR183RET
SCHEMBL149137 0.91 GPR119 (0.38) GPR119KCNH2GPR183RET
SCHEMBL149136 0.91 GPR119 (0.38) GPR119KCNH2GPR183RET
SCHEMBL149141 0.89 GPR119 (0.38) GPR119KCNH2GPR183
SCHEMBL149140 0.89 GPR119 (0.38) GPR119KCNH2GPR183

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-20120059014-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-08 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-20120059014-A1 Compounds for the Treatment of Metabolic Disorders GPR119, FFAR2, GPBAR1 GPR119 1/4885KCNH2 2010/4885NTRK1 4160/4885

“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.