SCHEMBL7556572

SCHEMBL7556572

CCc1cc(CC(N)=O)cc(Cc2cccc(Br)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.42
PARP15 Q460N3 2/20 0.41
PARP14 Q460N5 1/20 0.41
PARP10 Q53GL7 1/20 0.41
EGFR P00533 1/20 0.40
ERBB2 P04626 1/20 0.40
HCAR2 Q8TDS4 1/20 0.40
RIPK1 Q13546 1/20 0.40
SIGMAR1 Q99720 2/20 0.40
MAPK8 P45983 1/20 0.40
TAAR1 Q96RJ0 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
PTGES O14684 1/20 0.39

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
SCHEMBL27405624 0.83 CA2 (0.44)
SCHEMBL2578166 0.81 MAPK8 (0.52) PARP1PARP15PARP14PARP10EGFR
SCHEMBL7770956 0.78 LMNA (0.46) SIGMAR1
SCHEMBL1539285 0.74 TAAR1 (0.52) TAAR1
SCHEMBL7557354 0.73 PLA2G2A (0.53)
SCHEMBL80602 0.72
SCHEMBL29427107 0.72
SCHEMBL10339219 0.72 CA2 (0.54)
SCHEMBL9200966 0.72 TAAR1 (0.60) HCAR2TAAR1
Trifluoroacetic Acid SCHEMBL5657671 0.72 EGFR (0.46) PARP1PARP15PARP14PARP10EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946495-B1 PHENYL ACETAMIDES AS SPLA2 INHIBITORS LILLY CO ELI (US) 2002-07-24 EP disclosed
US-6353128-B1 FOR TREATMENT OF CONDITIONS SUCH AS SEPTIC SHOCK. ELI LILLY AND COMPANY 2002-03-05 US disclosed
EP-0946495-A4 PHENYL ACETAMIDES AS SPLA2 INHIBITORS LILLY CO ELI (US) 2000-04-12 EP disclosed
EP-0946495-A1 PHENYL ACETAMIDES AS SPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1999-10-06 EP disclosed
WO-1998024756-A1 PHENYL ACETAMIDES AS SPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1998-06-11 WO disclosed