SCHEMBL8924699

SCHEMBL8924699

CCOC(=O)Cc1cn(Cc2ccccc2)c2ccc(C(=O)P(=O)(OC)OC)cc12

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 6/20 0.51
ICMT O60725 5/20 0.47
F2RL3 Q96RI0 1/20 0.46
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43
F2 P00734 1/20 0.43
PRSS1 P07477 1/20 0.43
P2RX7 Q99572 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
PLA2G4A P47712 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
SCHEMBL8926150 0.87 PLA2G2A (0.67) PLA2G2AICMT
SCHEMBL7962690 0.82 PLA2G2A (0.74) PLA2G2AICMTMTNR1AMTNR1BPPARG
SCHEMBL7962123 0.79 PLA2G2A (0.64) PLA2G2AICMTMTNR1AMTNR1BPPARG
SCHEMBL8298657 0.78 PPARD (0.65) PLA2G2AICMTMTNR1AMTNR1BPPARG
SCHEMBL8924471 0.78 PLA2G2A (0.46) PLA2G2AICMTF2RL3MTNR1AMTNR1B
SCHEMBL7962127 0.75 PLA2G2A (0.66) PLA2G2AICMTPPARGPPARDPPARA
SCHEMBL8924302 0.74 PLA2G2A (0.68) PLA2G2AICMT
SCHEMBL8290865 0.74 PLA2G2A (0.74) PLA2G2AICMTMTNR1AMTNR1BPPARG
SCHEMBL8926055 0.73 PLA2G2A (0.67) PLA2G2AICMT
SCHEMBL8173457 0.73 PLA2G2A (0.55) PLA2G2AICMTMTNR1AMTNR1BPPARG

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