SCHEMBL6848108

SCHEMBL6848108

CCCO[C@H]1C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 5/20 0.38
HSD17B10 Q99714 1/20 0.37
UCHL1 P09936 1/20 0.37
NR1H2 P55055 1/20 0.37
AGTR2 P50052 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL6848260 1.00 MCL1 (0.38) MCL1HSD17B10UCHL1NR1H2AGTR2
SCHEMBL6848258 1.00 MCL1 (0.38) MCL1HSD17B10UCHL1NR1H2AGTR2
SCHEMBL6848111 1.00 MCL1 (0.38) MCL1HSD17B10UCHL1NR1H2AGTR2
SCHEMBL20446593 1.00 MCL1 (0.38) MCL1HSD17B10UCHL1NR1H2AGTR2
SCHEMBL12800440 0.92 AGTR2 (0.39) MCL1HSD17B10UCHL1NR1H2AGTR2
SCHEMBL30340428 0.89 AGTR2 (0.40) MCL1HSD17B10UCHL1NR1H2AGTR2
SCHEMBL30340394 0.89 AGTR2 (0.40) MCL1HSD17B10UCHL1NR1H2AGTR2
SCHEMBL85533 0.89 HSD17B10 (0.39) MCL1HSD17B10UCHL1NR1H2AGTR2
SCHEMBL1162888 0.89 HSD17B10 (0.39) MCL1HSD17B10UCHL1NR1H2AGTR2
SCHEMBL6121564 0.89 HSD17B10 (0.39) MCL1HSD17B10UCHL1NR1H2AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6770741-B1 USEFUL IN TREATING CONDITIONS AND DISEASES OF A MAMMAL AND HUMAN IN WHICH AN EXCESS OF BRADYKININ OR RELATED KININS ARE PRODUCED OR INJECTED SUCH AS BY INSECT BITES SCIOS INC. 2004-08-03 US disclosed
US-6288036-B1 ANTIINFLAMMATORY, ANTIASTHMATIC, ANTIALLERGEN, AND ANALGESIC AGENTS; ARGININE-CONTAINING NONA- OR DECAPEPTIDES SCIOS INC. 2001-09-11 US disclosed
EP-0618810-B1 BRADYKININ ANTAGONIST PEPTIDES SCIOS NOVA INC (US) 2001-07-04 EP disclosed
EP-0618809-B1 BRADYKININ TYPE PEPTIDES SCIOS NOVA INC (US) 1998-08-19 EP disclosed
US-5385889-A Substitution of L-proline at the 7-position of the peptide hormone with a D-configuration hydroxyproline ether or thioether converts agonist into antagonist SCIOS NOVA INC. (US) 1995-01-31 US disclosed
EP-0618810-A4 BRADYKININ ANTAGONIST PEPTIDES. SCIOS NOVA INC (US) 1994-12-07 EP disclosed
EP-0618810-A1 BRADYKININ ANTAGONIST PEPTIDES SCIOS NOVA INC. (US) 1994-10-12 EP disclosed
WO-1992018156-A1 BRADYKININ ANTAGONIST PEPTIDES NOVA TECHNOLOGY LIMITED PARTNERSHIP (US) 1992-10-29 WO disclosed