SCHEMBL6625318

SCHEMBL6625318

CCCC(O)(S)C(=O)OC

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.33
FDPS P14324 1/20 0.33
LMNA P02545 2/20 0.33
USP2 O75604 1/20 0.33
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 2/20 0.32
DGAT1 O75907 1/20 0.32
TSHR P16473 1/20 0.32
SRC P12931 1/20 0.31
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ELANE P08246 1/20 0.30
GAA P10253 1/20 0.30
ALOX12 P18054 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL9540416 0.81
SCHEMBL27887840 0.76 FDPS (0.36) KCNN4FDPSLMNAUSP2HSD17B10
SCHEMBL28157328 0.76 FDPS (0.36) KCNN4FDPSLMNAUSP2HSD17B10
SCHEMBL23089887 0.76 FDPS (0.35) FDPSLMNAHSD17B10ALDH1A1DGAT1
SCHEMBL28173152 0.74 AR (0.39) FDPSLMNAUSP2HSD17B10ALDH1A1
SCHEMBL808737 0.73 MEN1 (0.38) KCNN4FDPSLMNAUSP2HSD17B10
SCHEMBL9243513 0.73 DGAT1 (0.41) KCNN4FDPSLMNAUSP2HSD17B10
SCHEMBL11592929 0.73 DGAT1 (0.36) KCNN4FDPSLMNAUSP2HSD17B10
SCHEMBL9141375 0.73 DGAT1 (0.36) KCNN4FDPSLMNAUSP2HSD17B10
SCHEMBL459604 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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