SCHEMBL7908658

SCHEMBL7908658

CSC(=O)N[C@@H](CCCCNC(C)=NO)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 16/20 0.48
SMN1; SMN2 Q16637 1/20 0.41
ALB P02768 2/20 0.39
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
PGGT1B P53609 1/20 0.37

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
SCHEMBL7908703 1.00 FOLH1 (0.48) FOLH1SMN1; SMN2ALBFNTAFNTB
SCHEMBL7901699 0.82 FOLH1 (0.49) FOLH1SMN1; SMN2ALB
SCHEMBL7915383 0.81 FOLH1 (0.56) FOLH1SMN1; SMN2
SCHEMBL7915392 0.81 FOLH1 (0.56) FOLH1SMN1; SMN2
SCHEMBL7909235 0.80 FOLH1 (0.43) FOLH1SMN1; SMN2
SCHEMBL7909229 0.80 FOLH1 (0.43) FOLH1SMN1; SMN2
SCHEMBL7225059 0.79 NOD1 (0.47) FOLH1SMN1; SMN2ALBFNTAFNTB
SCHEMBL7227075 0.79 NOD1 (0.50) FOLH1SMN1; SMN2FNTAFNTBPGGT1B
SCHEMBL7227064 0.79 NOD1 (0.50) FOLH1SMN1; SMN2FNTAFNTBPGGT1B
SCHEMBL7225046 0.79 NOD1 (0.47) FOLH1SMN1; SMN2ALBFNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6207708-B1 FOR THERAPY AND PROPHYLAXIS OF AUTOIMMUNE AND/OR INFLAMMATORY CONDITIONS AFFECTING THE JOINTS SUCH AS ARTHRITIS, AND INFLAMMATORY BOWEL DISEASE, CARDIVASCULAR ISCHEMIA, DIABETES, CONGESTIVE HEART FAILURE, MYOCARDITIS, ATHEROSCLEROSIS, G. D. SEARLE & COMPANY 2001-03-27 US claimed
EP-0885188-B1 HYDROXYAMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS SEARLE & CO (US) 2000-09-27 EP claimed
EP-0885188-A1 HYDROXYAMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS G.D. SEARLE & CO. (US) 1998-12-23 EP claimed
WO-1997032844-A1 HYDROXYAMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS G.D. SEARLE & CO. (US) 1997-09-12 WO claimed
US-6207708-B1 FOR THERAPY AND PROPHYLAXIS OF AUTOIMMUNE AND/OR INFLAMMATORY CONDITIONS AFFECTING THE JOINTS SUCH AS ARTHRITIS, AND INFLAMMATORY BOWEL DISEASE, CARDIVASCULAR ISCHEMIA, DIABETES, CONGESTIVE HEART FAILURE, MYOCARDITIS, ATHEROSCLEROSIS, G. D. SEARLE & COMPANY 2001-03-27 US disclosed