SCHEMBL6507574

SCHEMBL6507574

CON(C)C(=O)[C@@H]1CSCN1C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.41
HSD17B10 Q99714 2/20 0.38
USP30 Q70CQ3 3/20 0.34
UCHL1 P09936 1/20 0.33
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PREP P48147 2/20 0.32
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
ACE P12821 1/20 0.31

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
SCHEMBL5307511 1.00 ATM (0.41) ATMHSD17B10USP30UCHL1USP2
SCHEMBL6904287 0.86 HSD17B10 (0.36) HSD17B10USP30UCHL1SMN1; SMN2PREP
SCHEMBL6904285 0.86 HSD17B10 (0.36) HSD17B10USP30UCHL1SMN1; SMN2PREP
SCHEMBL13103213 0.81 UCHL1 (0.38) HSD17B10UCHL1USP2SMN1; SMN2CHRM2
SCHEMBL9409879 0.81 ACE (0.37) HSD17B10PREPACE
SCHEMBL9409883 0.81 ACE (0.37) HSD17B10PREPACE
SCHEMBL200925 0.80 ATM (0.46) ATMHSD17B10USP2SMN1; SMN2PREP
SCHEMBL200923 0.80 ATM (0.46) ATMHSD17B10USP2SMN1; SMN2PREP
SCHEMBL202300 0.79 ACE (0.48) ATMHSD17B10USP2SMN1; SMN2PREP
SCHEMBL1022969 0.79 ACE (0.48) ATMHSD17B10USP2SMN1; SMN2PREP

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
WO-2005037828-A1 NOVEL INHIBITORS OF DPP-IV, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT LG LIFE SCIENCES LTD. (KR) 2005-04-28 WO disclosed
EP-0986384-A4 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2004-09-15 EP disclosed
US-6310095-B1 INHIBITING OR TREATING CANCER, TREATING INTIMAL HYPERPLASIA ASSOCIATED WITH RESTENOSIS AND ATHEROSCLEROSIS, INHIBITING POST-TRANSLATIONAL MODIFICATION OF ONCOGENIC RAS PROTEIN BY PROTEIN FARNESYLTRANSFERASE AND/OR GERANYLGERANYLTRANSFERASE UNIVERSITY OF PITTSBURGH 2001-10-30 US disclosed
EP-0986384-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 2000-03-22 EP disclosed
WO-1998050029-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1998-11-12 WO disclosed