SCHEMBL7112229

SCHEMBL7112229

CC(C)(C)OC(=O)Nc1ccc(OC2CCN(c3ccncc3)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.49
NAMPT P43490 13/20 0.48
CYP17A1 P05093 2/20 0.48
ACACB O00763 1/20 0.45
HRH3 Q9Y5N1 1/20 0.43

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
SCHEMBL7119023 0.88 F10 (0.51) F10
SCHEMBL5632393 0.84 NAMPT (0.56) F10NAMPTACACBHRH3
SCHEMBL9013870 0.81 GPR119 (0.60) NAMPT
SCHEMBL5631723 0.79 ACACB (0.45) NAMPTACACBHRH3
SCHEMBL1456142 0.77 CKS1B (0.54) NAMPT
SCHEMBL9760149 0.76 IDO1 (0.45) NAMPTACACBHRH3
SCHEMBL5633968 0.76 NAMPT (0.43) F10NAMPTACACBHRH3
SCHEMBL7379121 0.76 ACACB (0.43) NAMPTACACBHRH3
SCHEMBL3573442 0.76 GPR119 (0.50) NAMPT
SCHEMBL30738792 0.75 EPHX2 (0.43) CYP17A1HRH3

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-20030207882-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED 2003-11-06 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-20030207882-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents F2, SERPINC1, F11 F10 8/4885NAMPT 3430/4885CYP17A1 1389/4885

“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.