SCHEMBL7307178

SCHEMBL7307178

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

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.39
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CTSK P43235 4/20 0.34
CTSS P25774 3/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
ELANE P08246 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
HTT P42858 1/20 0.30
GAA P10253 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL7540300 0.96 DGAT1 (0.39) DGAT1LMNAHSD17B10CTSKCTSS
SCHEMBL7427784 0.82 DGAT1 (0.52) DGAT1LMNAHSD17B10CTSKCTSS
SCHEMBL4014794 0.80 FFAR3 (0.35) LMNAHSD17B10ELANEALDH1A1CYP1A2
SCHEMBL31462329 0.79 DGAT1 (0.39) DGAT1LMNAHSD17B10CTSKCTSS
SCHEMBL27343845 0.79 DGAT1 (0.39) DGAT1LMNAHSD17B10CTSKCTSS
SCHEMBL27877903 0.77 LMNA (0.31) LMNAHSD17B10
SCHEMBL375735 0.77 FFAR3 (0.38) LMNAHSD17B10ALDH1A1CYP1A2CYP2C19
SCHEMBL6372947 0.76 DGAT1 (0.36) DGAT1LMNAHSD17B10CTSKCTSS
SCHEMBL24487968 0.76 DGAT1 (0.43) DGAT1LMNAHSD17B10CTSKCTSS
SCHEMBL18467265 0.76 ELANE (0.46) DGAT1LMNAHSD17B10CTSKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0684240-B1 Hydroxamic acid derivatives with three ring substituents HOFFMANN LA ROCHE (CH) 2000-08-02 EP disclosed
US-6066662-A USE IN CONTROL OR PREVENTION OF RHEUMATOID ARTHRITIS AND OSTEOARTHRITIS OR IN THE TREATMENT OF INVASIVE TUMOURS, ATHEROSCLEROSIS OR MULTIPLE SCLEROSIS HOFFMANN-LA ROCHE INC. (US) 2000-05-23 US disclosed
US-5731441-A COLLAGENASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 1998-03-24 US disclosed
US-5710167-A Hydroxamic acid derivatives with tricyclic substitution for treating degenerative joint diseases HOFFMANN-LA ROCHE INC. (US) 1998-01-20 US disclosed
US-5698690-A COLLAGENASE INHIBITORS; TREATMENT OF DEGENERATIVE JOINT DISEASES HOFFMANN-LA ROCHE INC. (US) 1997-12-16 US disclosed
US-5614625-A COLLAGENASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 1997-03-25 US disclosed
EP-0763013-A1 HYDROXYLAMINE DERIVATIVES AND THEIR USE AS METALLOPROTEINASE INHIBITING AGENTS F. HOFFMANN-LA ROCHE AG (CH) 1997-03-19 EP disclosed
WO-1995033709-A1 HYDROXYLAMINE DERIVATIVES AND THEIR USE AS METALLOPROTEINASE INHIBITING AGENTS F. HOFFMANN-LA ROCHE AG (CH) 1995-12-14 WO disclosed
EP-0684240-A1 Hydroxamic acid derivatives with tricyclic substitution F. HOFFMANN-LA ROCHE AG (CH) 1995-11-29 EP disclosed