SCHEMBL6777696

SCHEMBL6777696

CCc1cc(O)c2c3c(C(N)=O)cccc3n(Cc3ccccc3)c2c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 18/20 0.47
PLA2G10 O15496 2/20 0.41
PLA2G1B P04054 2/20 0.41
PLA2G5 P39877 2/20 0.41
PLA2G2F Q9BZM2 2/20 0.41
PLA2G2E Q9NZK7 2/20 0.41
PLA2G2D Q9UNK4 2/20 0.41
PLA2G6 O60733 1/20 0.41
PLA2G2C Q5R387 1/20 0.41
PLA2G12B Q9BX93 1/20 0.41
PLA2G12A Q9BZM1 1/20 0.41
PLA2G3 Q9NZ20 1/20 0.41
TSHR P16473 1/20 0.41
PARP1 P09874 1/20 0.40

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
SCHEMBL6773912 0.93 PLA2G2A (0.45) PLA2G2APLA2G10PLA2G1BPLA2G5PLA2G2F
SCHEMBL6777282 0.93 PLA2G2A (0.41) PLA2G2APLA2G10PLA2G1BPLA2G5PLA2G2F
SCHEMBL6776827 0.91 PLA2G2A (0.53) PLA2G2APLA2G1B
SCHEMBL6775435 0.91 PLA2G2A (0.40) PLA2G2A
SCHEMBL6774766 0.90 ALDH1A1 (0.43) PLA2G2APARP1
SCHEMBL6776234 0.90 PLA2G2A (0.47) PLA2G2APLA2G10PLA2G1BPLA2G5PLA2G2F
SCHEMBL6777588 0.89 F10 (0.40) PLA2G2APARP1
SCHEMBL6774816 0.89 LMNA (0.43) PLA2G2ATSHR
SCHEMBL5212214 0.88 PPARG (0.46) PLA2G2A
SCHEMBL6777431 0.88 PARP1 (0.41) PLA2G2APLA2G10PARP1

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