SCHEMBL2706134

SCHEMBL2706134

CC(C)(C)OC(=O)N1CCC[C@@H]1c1nc2ccc(Br)cc2[nH]1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 20/20 0.58
HCRTR2 O43614 20/20 0.58

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
SCHEMBL38658108 1.00 HCRTR1 (0.58) HCRTR1HCRTR2
SCHEMBL204028 1.00 HCRTR1 (0.58) HCRTR1HCRTR2
SCHEMBL1293520 1.00 HCRTR1 (0.58) HCRTR1HCRTR2
SCHEMBL16215441 0.97 HCRTR1 (0.55) HCRTR1HCRTR2
SCHEMBL17277682 0.97 HCRTR1 (0.55) HCRTR1HCRTR2
SCHEMBL12327656 0.97 HCRTR1 (0.55) HCRTR1HCRTR2
SCHEMBL1357196 0.92 HCRTR1 (0.56) HCRTR1HCRTR2
SCHEMBL1357197 0.92 HCRTR1 (0.56) HCRTR1HCRTR2
SCHEMBL1982286 0.92 HCRTR1 (0.49) HCRTR1HCRTR2
SCHEMBL29724469 0.92 HCRTR1 (0.49) HCRTR1HCRTR2

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-8088368-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2012-01-03 US disclosed
US-20100310512-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2010-12-09 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-20100310512-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 HCRTR1 4298/4885HCRTR2 4654/4885

“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.