SCHEMBL10784668

SCHEMBL10784668

CCCCCCCCC(CCCCCC)COc1ccc(C(=O)O)cc1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 8/20 0.68
TP53 P04637 1/20 0.68
TSHR P16473 1/20 0.68
RARB P10826 5/20 0.62
PLA2G4A P47712 1/20 0.59
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50

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
SCHEMBL10785284 0.99 PLA2G4B (0.67) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL3842241 0.90 PLA2G4B (0.55) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL5471637 0.88 PLA2G4B (0.60) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL25788025 0.87 TP53 (0.75) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL9417076 0.86 PLA2G4B (0.65) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL8457408 0.86 PLA2G4B (0.65) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL9574345 0.86 PLA2G4B (0.65) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL9574428 0.86 PLA2G4B (0.65) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL9574307 0.86 PLA2G4B (0.65) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL8457405 0.86 PLA2G4B (0.65) PLA2G4BTP53TSHRRARBPLA2G4A

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-4684665-A Sebosuppressive benzoic acid ester derivatives and cosmetic preparations containing them HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1987-08-04 US disclosed