SCHEMBL14607289

SCHEMBL14607289

C=C1C(Oc2ccc(CCCCNC(=N)NC(=O)c3nc(Cl)c(N)nc3N)cc2)OC(C(=O)O)C(=C)[C@@H]1O

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SCNN1A P37088 20/20 0.50

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
SCHEMBL9913760 0.81 SCNN1A (0.74) SCNN1A
SCHEMBL19365974 0.80 SCNN1A (0.60) SCNN1A
SCHEMBL19361225 0.79 SCNN1A (0.65) SCNN1A
SCHEMBL10062650 0.79 SCNN1A (0.67) SCNN1A
SCHEMBL14210760 0.78 SCNN1A (0.57) SCNN1A
SCHEMBL12120463 0.78 SCNN1A (0.64) SCNN1A
SCHEMBL9913772 0.78 SCNN1A (0.64) SCNN1A
SCHEMBL9913788 0.77 SCNN1A (0.56) SCNN1A
SCHEMBL9913763 0.77 SCNN1A (0.53) SCNN1A
SCHEMBL911224 0.77 SCNN1A (0.61) SCNN1A

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-7192960-B2 Antihistamines; bronchodilators; antiinflammatory agents; inflammatory bowel disorders PARION SCIENCES, INC. (US) 2007-03-20 US disclosed