SCHEMBL7006597

SCHEMBL7006597

[CH2]C(C)CCCCCCCCC([CH2])C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.36
TRPA1 O75762 1/20 0.36
LMNA P02545 1/20 0.35
OPRM1 P35372 1/20 0.32
GPR84 Q9NQS5 3/20 0.31
SPHK1 Q9NYA1 1/20 0.31
FFAR1 O14842 1/20 0.31

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
SCHEMBL7008843 1.00 TRPV1 (0.36) TRPV1TRPA1LMNAOPRM1GPR84
SCHEMBL10986825 1.00 TRPV1 (0.36) TRPV1TRPA1LMNAOPRM1GPR84
SCHEMBL5985454 0.96 LMNA (0.37) TRPV1TRPA1LMNAOPRM1
SCHEMBL28419560 0.90 LMNA (0.50) TRPV1TRPA1LMNA
SCHEMBL11720335 0.90 LMNA (0.50) TRPV1TRPA1LMNA
SCHEMBL29183000 0.90 LMNA (0.50) TRPV1TRPA1LMNA
SCHEMBL3267924 0.90 LMNA (0.50) TRPV1TRPA1LMNA
SCHEMBL3883339 0.90 LMNA (0.50) TRPV1TRPA1LMNA
SCHEMBL20335504 0.90 LMNA (0.50) TRPV1TRPA1LMNA
SCHEMBL5985551 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0772593-B1 THIOPYRIDYL COMPOUNDS FOR CONTROLLING HELICOBACTER BACTERIA ALTANA PHARMA AG (DE) 2003-05-02 EP disclosed
EP-0772593-A1 THIOPYRIDYL COMPOUNDS FOR CONTROLLING HELICOBACTER BACTERIA Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1997-05-14 EP disclosed
EP-0764161-A1 SUBSTITUTED ARYLALKYLTHIOALKYLTHIOPYRIDINES FOR USE IN THE CONTROL OF HELICOBACTER BACTERIA Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1997-03-26 EP disclosed
WO-1996002505-A1 THIOPYRIDYL COMPOUNDS FOR CONTROLLING HELICOBACTER BACTERIA BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1996-02-01 WO disclosed
WO-1996000224-A1 4-S- AND N-SUBSTITUTED 6-ALKYLPYRIDINES FOR CONTROLLING HELICOBACTER BACTERIA BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1996-01-04 WO disclosed
WO-1995034554-A1 SUBSTITUTED ARYLALKYLTHIOALKYLTHIOPYRIDINES FOR USE IN THE CONTROL OF HELICOBACTER BACTERIA BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1995-12-21 WO disclosed