SCHEMBL14572686

SCHEMBL14572686

COC(=O)c1ccc(CCCCNC(=N)NC(=O)c2nc(Cl)c(N)nc2NCl)cc1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCNN1A P37088 18/20 0.56
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40

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
SCHEMBL9913782 0.91 SCNN1A (0.68) SCNN1A
SCHEMBL10062414 0.81 SCNN1A (0.60) SCNN1A
SCHEMBL12251653 0.81 SCNN1A (0.55) SCNN1A
SCHEMBL12251668 0.81 SCNN1A (0.55) SCNN1A
SCHEMBL13907673 0.81 SCNN1A (0.54) SCNN1A
SCHEMBL10062650 0.81 SCNN1A (0.67) SCNN1A
SCHEMBL2331940 0.80 SCNN1A (0.58) SCNN1A
SCHEMBL13912813 0.80 SCNN1A (0.54) SCNN1A
SCHEMBL2054438 0.79 SCNN1A (0.54) SCNN1A
SCHEMBL16808735 0.79 SCNN1A (0.54) 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 2 patents. 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
US-7186833-B2 Such as 4-(4-hydroxyphenyl)butylamidino-3,5-diamino-6-chloropyrazinecarboxamide hydrochloride; time-release agents; for therapy of chronic bronchitis, emphysema, cystic fibrosis, and eye disorders PARION SCIENCES, INC. (US) 2007-03-06 US disclosed