SCHEMBL11041922

SCHEMBL11041922

CC(=CCCC(C)=CCOCc1ccccc1)CCC=C(C)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.51
LSS P48449 2/20 0.49
PPARG P37231 1/20 0.47
BACE1 P56817 1/20 0.45
ICMT O60725 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL11045642 1.00 TRPV1 (0.51) TRPV1LSSPPARGBACE1ICMT
SCHEMBL11038479 1.00 TRPV1 (0.51) TRPV1LSSPPARGBACE1ICMT
SCHEMBL11041918 1.00 TRPV1 (0.51) TRPV1LSSPPARGBACE1ICMT
SCHEMBL11045639 1.00 TRPV1 (0.51) TRPV1LSSPPARGBACE1ICMT
SCHEMBL1074171 0.99 TRPV1 (0.52) TRPV1LSSPPARGBACE1ICMT
SCHEMBL1074168 0.99 TRPV1 (0.52) TRPV1LSSPPARGBACE1ICMT
SCHEMBL12377552 0.86 LSS (0.51) TRPV1LSSICMT
SCHEMBL12377556 0.86 TRPV1 (0.59) TRPV1LSSICMT
SCHEMBL11039509 0.86 TRPV1 (0.59) TRPV1LSSICMT
SCHEMBL11039511 0.86 TRPV1 (0.59) TRPV1LSSICMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4454330-A Two-functional-group-containing terpenoids, processes for the preparation of the same, and anti-ulcer agents containing the same EISAI CO., LTD. (JP) 1984-06-12 US claimed