SCHEMBL8298577

SCHEMBL8298577

COc1ccc2c(c1)c(CC(=O)NN)cn2Cc1ccccc1-c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 16/20 0.76
MTNR1A P48039 1/20 0.52
MTNR1B P49286 1/20 0.52
ICMT O60725 2/20 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
SCHEMBL7962843 0.86 PLA2G2A (1.00) PLA2G2AMTNR1AMTNR1BICMT
SCHEMBL8292273 0.85 PLA2G2A (0.57) PLA2G2AMTNR1AMTNR1BICMT
SCHEMBL7965182 0.82 PLA2G2A (1.00) PLA2G2A
SCHEMBL8298844 0.80 PLA2G2A (1.00) PLA2G2A
SCHEMBL9096563 0.76 PLA2G2A (0.80) PLA2G2AMTNR1AMTNR1B
SCHEMBL7963252 0.76 PLA2G2A (1.00) PLA2G2AMTNR1AMTNR1BICMT
SCHEMBL20769739 0.75 PLA2G2A (0.83) PLA2G2AMTNR1AMTNR1BICMT
SCHEMBL8299582 0.75 PLA2G2A (0.78) PLA2G2AMTNR1AMTNR1BICMT
SCHEMBL8292030 0.75 PLA2G2A (0.77) PLA2G2AMTNR1AMTNR1B
SCHEMBL4658955 0.72 PLA2G2A (0.51) PLA2G2AMTNR1AMTNR1BICMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0620214-B1 1H-indole-3-acetic acid hydrazide sPLA2 inhibitors LILLY CO ELI (US) 1999-03-03 EP disclosed
US-5578634-A SEPTIC SHOCK TREATMENT ELI LILLY AND COMPANY (US) 1996-11-26 US disclosed
EP-0620214-A1 1H-indole-3-acetic acid hydrazide sPLA2 inhibitors ELI LILLY AND COMPANY (US) 1994-10-19 EP disclosed