SCHEMBL9283308

SCHEMBL9283308

C=CCn1c(OC(=O)OCC)c(C(=O)CCCCCCCCCCCCCCCCC)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HTT P42858 1/20 0.45
PLA2G2A P14555 3/20 0.44

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
SCHEMBL9265671 0.83 OXER1 (0.54) PLA2G2A
SCHEMBL9270261 0.83 OXER1 (0.54) PLA2G2A
SCHEMBL9265228 0.82 PLA2G2A (0.52) ALDH1A1HTTPLA2G2A
SCHEMBL9271951 0.82 CNR2 (0.55) PLA2G2A
SCHEMBL9282528 0.81 GABRA1 (0.44) PLA2G2A
SCHEMBL7213227 0.80 PLA2G2A (0.43) PLA2G2A
SCHEMBL7211881 0.79 PSEN1 (0.54) PLA2G2A
SCHEMBL7206888 0.78 PLA2G2A (0.40) PLA2G2A
SCHEMBL9263602 0.76 PLA2G2A (0.58) PLA2G2A
SCHEMBL9264177 0.76 PLA2G2A (0.58) PLA2G2A

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
WO-1995013266-A1 ACYLPYRROLE-ALKANOIC ACIDS AND INDOLE-2-ALKANOIC ACIDS PLUS THEIR DERIVATIVES FOR USE AS INHIBITORS OF PHOSPHOLIPASE A¿2? MERCKLE GMBH CHEM.-PHARM. FABRIK (DE) 1995-05-18 WO disclosed