SCHEMBL7754864

SCHEMBL7754864

CCCCCC(CCCC)CCC(CCOCCOCCC(CCC(CCCC)CCCCC)CC(O)=S)CC(O)=S

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
CYP3A4 P08684 1/20 0.33
ALDH1A1 P00352 1/20 0.32
GPR84 Q9NQS5 7/20 0.32
SMPD1 P17405 3/20 0.31
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 2/20 0.31
FFAR1 O14842 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
SCHEMBL7755407 1.00 LMNA (0.36) LMNAMEN1THRBHTTKMT2A
SCHEMBL7754014 0.98 LMNA (0.37) LMNAMEN1THRBHTTKMT2A
SCHEMBL7756128 0.94 CYP3A4 (0.33) LMNAMEN1THRBHTTKMT2A
SCHEMBL7752041 0.94 CYP3A4 (0.33) LMNAMEN1THRBHTTKMT2A
SCHEMBL8757628 0.93 ALDH1A1 (0.34) LMNAMEN1THRBHTTKMT2A
SCHEMBL7755395 0.93 LMNA (0.42) LMNAMEN1THRBHTTKMT2A
SCHEMBL7756115 0.93 ALDH1A1 (0.34) LMNAMEN1THRBHTTKMT2A
SCHEMBL9073883 0.93 LMNA (0.42) LMNAMEN1THRBHTTKMT2A
SCHEMBL7752021 0.92 ALDH1A1 (0.33) LMNACYP3A4ALDH1A1
SCHEMBL7755400 0.92 ALDH1A1 (0.35) LMNACYP3A4ALDH1A1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0764636-B1 Thiopropionate synergists GOODYEAR TIRE & RUBBER (US) 2001-03-07 EP disclosed
EP-0764636-A2 Thiopropionate synergists THE GOODYEAR TIRE & RUBBER COMPANY (US) 1997-03-26 EP disclosed