SCHEMBL6720082

SCHEMBL6720082

CCOP(COc1ccc2c(c1)c1c(n2Cc2ccc(OC)cc2)CCCC1C(N)=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.50
PLA2G2A P14555 2/20 0.40
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 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
SCHEMBL6774375 0.91 HTR6 (0.48) HTR6PLA2G2AHDAC2HDAC8HDAC6
SCHEMBL6699402 0.83 HTR6 (0.71) HTR6PLA2G2A
SCHEMBL11837498 0.76 HTR6 (0.60) HTR6PLA2G2AHDAC6
SCHEMBL29862561 0.76 PLA2G2A (0.59) HTR6PLA2G2A
SCHEMBL818539 0.76 PLA2G2A (0.59) HTR6PLA2G2A
SCHEMBL11824093 0.76 HTR6 (0.70) HTR6PLA2G2A
SCHEMBL6694896 0.75 PLA2G2A (0.59) HTR6PLA2G2A
SCHEMBL11827008 0.75 HTR6 (0.69) HTR6PLA2G2A
Hydrochloric Acid SCHEMBL11827022 0.75 HTR6 (0.69) HTR6PLA2G2A
SCHEMBL11826210 0.75 HTR6 (0.64) HTR6PLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040204473-A1 Substituted tricyclics LIN HO-SHEN (US) 2004-10-14 US disclosed
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-20030096854-A1 Substituted tricyclics ELI LILLY AND COMPANY 2003-05-22 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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030096854-A1 Substituted tricyclics LITAF, PLA2G4A, LTC4S HTR6 475/4885PLA2G2A 34/4885HDAC2 1060/4885
US-20040204473-A1 Substituted tricyclics PLA2G4A, PLAA, LTC4S HTR6 376/4885PLA2G2A 28/4885HDAC2 1057/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.