SCHEMBL14029031

SCHEMBL14029031

CCN1CC[C@@H](C(C#N)(c2ccccc2)c2ccccc2)C1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 3/20 0.46
MEN1 O00255 12/20 0.43
OPRM1 P35372 1/20 0.41
HRH1 P35367 1/20 0.39

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
SCHEMBL2619538 1.00 KCNA3 (0.46) KCNA3MEN1OPRM1HRH1
SCHEMBL14125383 1.00 KCNA3 (0.46) KCNA3MEN1OPRM1HRH1
SCHEMBL11226666 0.88 KCNA3 (0.40) KCNA3MEN1OPRM1
SCHEMBL11832164 0.87 MEN1 (0.42) KCNA3MEN1
SCHEMBL11732329 0.85 KCNA3 (0.43) KCNA3MEN1
SCHEMBL956109 0.84 KCNA3 (0.49) KCNA3HRH1
SCHEMBL956111 0.84 KCNA3 (0.49) KCNA3HRH1
Hydrochloric Acid SCHEMBL954583 0.83 KCNA3 (0.48) KCNA3HRH1
Hydrochloric Acid SCHEMBL954585 0.83 KCNA3 (0.48) KCNA3HRH1
SCHEMBL10867644 0.83 KCNA3 (0.44) KCNA3MEN1OPRM1HRH1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7442806-B2 Processes for preparing darifenacin hydrobromide TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2008-10-28 US disclosed
US-20070197631-A1 Processes for preparing darifenacin hydrobromide TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2007-08-23 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-20070197631-A1 Processes for preparing darifenacin hydrobromide OPRL1, AVPR2, AVPR1B KCNA3 1388/4885MEN1 2021/4885OPRM1 36/4885

“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.