SCHEMBL609745

SCHEMBL609745

CC(C)(C)OC(=O)N[C@H]1CN(c2cnc(C#N)cn2)C[C@@H]1c1cc(F)ccc1F

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RET P07949 13/20 0.44
DPP4 P27487 1/20 0.42
NTRK1 P04629 3/20 0.41
TACR3 P29371 1/20 0.39
MCHR1 Q99705 1/20 0.39
BRD4 O60885 1/20 0.38

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
SCHEMBL14723500 0.86 NTRK1 (0.42) RETDPP4NTRK1MCHR1
SCHEMBL14730294 0.86 NTRK1 (0.42) RETDPP4NTRK1MCHR1
SCHEMBL14722263 0.85 NTRK1 (0.43) RETDPP4NTRK1MCHR1
SCHEMBL14730278 0.85 NTRK1 (0.43) RETDPP4NTRK1MCHR1
SCHEMBL609161 0.84 AAK1 (0.41) RETDPP4NTRK1
SCHEMBL1720753 0.83 NTRK1 (0.40) RETNTRK1MCHR1
SCHEMBL609468 0.83 NTRK1 (0.40) RETNTRK1MCHR1
SCHEMBL10058396 0.83 NTRK1 (0.40) RETDPP4NTRK1MCHR1
SCHEMBL14730297 0.83 NTRK1 (0.43) RETDPP4NTRK1MCHR1
SCHEMBL14723371 0.83 NTRK1 (0.43) RETDPP4NTRK1MCHR1

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-20120040953-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-02-16 US disclosed
US-20120040953-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-02-16 US disclosed
US-20120040953-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 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-20120040953-A1 Compounds for the Treatment of Metabolic Disorders GPR119, GPR132, FFAR2 RET 1439/4885DPP4 217/4885NTRK1 3765/4885

“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.