SCHEMBL4140742

SCHEMBL4140742

CCC1(CC)C[C@@H](N(C(N)=O)c2cccc3c2C[C@H](O)CC3)c2ccc(F)cc2O1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 17/20 0.49
CYP3A4 P08684 1/20 0.34
CFTR P13569 1/20 0.31
HTR6 P50406 1/20 0.31

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
SCHEMBL4137513 1.00 TRPV1 (0.49) TRPV1CYP3A4CFTRHTR6
SCHEMBL4125522 0.94 TRPV1 (0.45) TRPV1CYP3A4
SCHEMBL3766306 0.90 TRPV1 (0.41) TRPV1
SCHEMBL4133142 0.90 TRPV1 (0.41) TRPV1
SCHEMBL3322270 0.84 TRPV1 (0.54) TRPV1CYP3A4CFTR
SCHEMBL3327903 0.78 TRPV1 (0.38) TRPV1
SCHEMBL2364052 0.77 TRPV1 (0.44) TRPV1
SCHEMBL3322248 0.76 TRPV1 (0.80) TRPV1CYP3A4
SCHEMBL3319416 0.76 TRPV1 (0.80) TRPV1CYP3A4
SCHEMBL3322010 0.72 TRPV1 (0.72) TRPV1CYP3A4

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-20090143423-A1 SOLID DISPERSION PRODUCT CONTAINING N-ARYL UREA-BASED COMPOUND ABBOTT GMBH & CO. KG (DE) 2009-06-04 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-20090143423-A1 SOLID DISPERSION PRODUCT CONTAINING N-ARYL UREA-BASED COMPOUND U2SURP, UMPS, HNRNPUL1 TRPV1 4781/4885CYP3A4 276/4885CFTR 300/4885

“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.