SCHEMBL6624472

SCHEMBL6624472

CCCC(O)(S)C(=O)O.[CaH2]

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.36
ALDH1A1 P00352 4/20 0.35
TSHR P16473 1/20 0.35
FFAR3 O14843 2/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
GAA P10253 1/20 0.32
ALOX12 P18054 1/20 0.32
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL459604 0.97
SCHEMBL8072767 0.95 FDPS (0.36) FDPSALDH1A1TSHRFFAR3HDAC3
Ammonia Solution, Strong SCHEMBL28340659 0.95 FDPS (0.36) FDPSALDH1A1TSHRFFAR3HDAC3
Hydrochloric Acid SCHEMBL8072773 0.93 FDPS (0.34) FDPSALDH1A1TSHRFFAR3HDAC3
SCHEMBL7122285 0.83 AKR1B1 (0.37) ALDH1A1TSHRMEN1KMT2AHSD17B10
SCHEMBL18095169 0.76
SCHEMBL8065098 0.75
SCHEMBL14762676 0.75 FFAR3 (0.36) FDPSALDH1A1TSHRFFAR3HDAC3
SCHEMBL11061354 0.74 FFAR3 (0.35) FDPSALDH1A1TSHRFFAR3HDAC3
SCHEMBL2960036 0.72

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