SCHEMBL6776017

SCHEMBL6776017

NNC(=O)c1cccc2c1c1cc(OCCc3ccccc3)ccc1n2Cc1ccccc1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 15/20 0.48
PLA2G10 O15496 1/20 0.40
PLA2G1B P04054 1/20 0.40
PLA2G5 P39877 1/20 0.40
EGFR P00533 1/20 0.39
IGF1R P08069 1/20 0.39
FLT4 P35916 1/20 0.39
KDR P35968 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
SIRT2 Q8IXJ6 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
SCHEMBL6771316 0.91 PLA2G2A (0.49) PLA2G2APLA2G10PLA2G1BPLA2G5EGFR
SCHEMBL6771322 0.79 EGFR (0.50) PLA2G2AEGFRIGF1RFLT4KDR
SCHEMBL6771051 0.77 PLA2G2A (0.44) PLA2G2AEGFRIGF1RFLT4KDR
SCHEMBL6771056 0.77 PLA2G2A (0.44) PLA2G2AEGFRIGF1RFLT4KDR
SCHEMBL6776197 0.73 PLA2G2A (0.46) PLA2G2AEGFRIGF1RFLT4KDR
SCHEMBL6472462 0.72 PLA2G2A (0.48) PLA2G2A
SCHEMBL27517209 0.70 MAPT (0.42) PLA2G2A
SCHEMBL6470947 0.69 PDE4A (0.43) PLA2G2A
SCHEMBL6784089 0.68 PLA2G2A (0.43) PLA2G2A
SCHEMBL6983559 0.67 PLA2G2A (0.59) PLA2G2APLA2G1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6713645-B1 INHIBITING SPLA2 MEDIATED RELEASE OF FATTY ACIDS FOR TREATMENT OF CONDITIONS SUCH AS SEPTIC SHOCK ELI LILLY AND COMPANY 2004-03-30 US disclosed
EP-0839806-B1 Substituted tricyclics LILLY CO ELI (US) 2003-07-09 EP disclosed
US-6177440-B1 THERAPY FOR SEPSIS SHOCK; PHOSPHOLIPASE INHBITOR ELI LILLY AND COMPANY 2001-01-23 US disclosed
EP-0952149-A2 Substituted carbazoles, process for their preparation and their use as sPLA2 inhibitiors ELI LILLY AND COMPANY (US) 1999-10-27 EP disclosed
WO-1998018464-A1 SUBSTITUTED TRICYCLICS ELI LILLY AND COMPANY (US) 1998-05-07 WO disclosed
EP-0839806-A1 Substituted tricyclics ELI LILLY AND COMPANY (US) 1998-05-06 EP disclosed