SCHEMBL9030324

SCHEMBL9030324

CCOP(=O)(OCC)C(CCCCCCCC(=O)OC)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
TSHR P16473 2/20 0.40
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
PPARG P37231 1/20 0.36
ENPP2 Q13822 4/20 0.36
MEN1 O00255 1/20 0.36
HPGD P15428 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PLA2G4A P47712 2/20 0.36
PABPC1 P11940 1/20 0.36
APOBEC3A P31941 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
PLA2G2A P14555 2/20 0.36
SLC1A1 P43005 1/20 0.35

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
SCHEMBL4229201 0.83 GPR84 (0.47)
SCHEMBL13924959 0.83 GPR84 (0.47)
SCHEMBL5326687 0.83 GPR84 (0.47)
SCHEMBL9029322 0.81 FOLH1 (0.50) L3MBTL1TSHRALDH1A1LMNAPPARG
SCHEMBL1903133 0.79 CA2 (0.42) L3MBTL1SLC1A1
SCHEMBL11801523 0.79 POLB (0.43) TSHR
SCHEMBL1533394 0.76 CYP3A4 (0.37)
SCHEMBL4254005 0.76 TSHR (0.47) L3MBTL1TSHRALDH1A1LMNAENPP2
SCHEMBL194844 0.76 POLB (0.42) TSHR
SCHEMBL30045058 0.74 POLB (0.35) TSHRALDH1A1LMNAMEN1KMT2A

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-0699203-A1 THIOMARINOL DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND THEIR USE AS MICROBICIDES AND HERBICIDES SMITHKLINE BEECHAM PLC (GB) 1996-03-06 EP disclosed
WO-1994028001-A1 THIOMARINOL DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND THEIR USE AS MICROBICIDES AND HERBICIDES SMITHKLINE BEECHAM PLC (GB) 1994-12-08 WO disclosed