SCHEMBL6778298

SCHEMBL6778298

CCCCCc1cc(O)c2c3c(C(N)=O)cccc3n(Cc3ccccc3Cc3ccccc3)c2c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.43
CNR2 P34972 7/20 0.43
PLA2G2A P14555 3/20 0.42
PLA2G1B P04054 1/20 0.42
PPARG P37231 3/20 0.38
GPR55 Q9Y2T6 1/20 0.37
PPARA Q07869 1/20 0.36
KAT8 Q9H7Z6 3/20 0.36
EP300 Q09472 1/20 0.36
KAT5 Q92993 1/20 0.36
PLK1 P53350 1/20 0.35
BID P55957 2/20 0.34
BCL2L1 Q07817 2/20 0.34
MCL1 Q07820 2/20 0.34
BAK1 Q16611 2/20 0.34

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
SCHEMBL6778663 0.91 CNR2 (0.42) CNR1CNR2PLA2G2APPARGPPARA
SCHEMBL5212214 0.91 PPARG (0.46) PLA2G2APPARGPPARAKAT8
SCHEMBL6896241 0.90 CNR1 (0.42) CNR1CNR2PLA2G2APLA2G1BGPR55
SCHEMBL6776320 0.90 PPARG (0.41) CNR1CNR2PLA2G2APPARGGPR55
SCHEMBL6776234 0.90 PLA2G2A (0.47) PLA2G2APLA2G1BBCL2L1
SCHEMBL6776818 0.88 PPARG (0.45) PLA2G2APLA2G1BPPARGKAT8EP300
SCHEMBL6775148 0.88 CNR1 (0.42) CNR1CNR2PLA2G2APPARG
SCHEMBL6782670 0.88 ALDH1A1 (0.39) CNR1CNR2PPARGPPARAKAT8
SCHEMBL6771775 0.88 PPARG (0.39) CNR1CNR2PPARGPPARAKAT8
SCHEMBL6778112 0.87 PPARG (0.40) CNR1CNR2PLA2G2APLA2G1BPPARG

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
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
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