Sugi Predict

Sugi Predict / Compounds / SCHEMBL8924460

SCHEMBL8924460

SCHEMBL8924460

CCC(Oc1ccc2c(CC(N)=O)c(C)n(Cc3ccccc3)c2c1)C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 18/20 0.74
▸ PPARG P37231 2/20 0.56
▸ PPARA Q07869 2/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ CYP4X1 Q8N118 1/20 0.56

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
SCHEMBL8926192 0.92 PLA2G2A (0.71) PLA2G2APPARGPPARA
SCHEMBL8924528 0.92 PLA2G2A (0.71) PLA2G2A
SCHEMBL8924924 0.92 PLA2G2A (0.74) PLA2G2A
SCHEMBL8924862 0.87 PLA2G2A (0.69) PLA2G2A
SCHEMBL7963970 0.85 PLA2G2A (1.00) PLA2G2A
SCHEMBL8924421 0.84 PLA2G2A (0.71) PLA2G2A
SCHEMBL8925313 0.84 PLA2G2A (0.71) PLA2G2A
SCHEMBL8924518 0.82 PLA2G2A (0.74) PLA2G2A
SCHEMBL8926507 0.81 PLA2G2A (0.74) PLA2G2A
SCHEMBL8926120 0.81 PLA2G2A (0.74) 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
US-5684034-A INHIBITORS OF HUMAN NON-PANCREATIC SECRETORY PHOSPHOLIPASE A2, TREATMENT OF SEPTIC SHOCK, TRAUMA, RESPIRATORY DISORDERS, RHEUMATIC ARTHRITIS, INHIBITORS OF ARACHIDONIC ACID RELEASE ELI LILLY AND COMPANY (US) 1997-11-04 — — US disclosed