SCHEMBL5864630

SCHEMBL5864630

NC(=O)C1CCCCc2c1c1c(OCC(=O)O)cccc1n2Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 2/20 0.47
PLA2G2A P14555 12/20 0.46
PLA2G1B P04054 6/20 0.44
PLA2G10 O15496 3/20 0.43
PLA2G2E Q9NZK7 3/20 0.43
PLA2G5 P39877 2/20 0.43
PLA2G2F Q9BZM2 2/20 0.42
PLA2G2D Q9UNK4 2/20 0.42
PLA2G6 O60733 1/20 0.42
PLA2G2C Q5R387 1/20 0.42
PLA2G12B Q9BX93 1/20 0.42
PLA2G12A Q9BZM1 1/20 0.42
PLA2G3 Q9NZ20 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.41
S1PR1 P21453 2/20 0.39
S1PR5 Q9H228 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL5512767 0.94 PLA2G2A (0.48) FABP4PLA2G2APLA2G1BPLA2G10PLA2G2E
SCHEMBL5864625 0.93 PLA2G2A (0.48) FABP4PLA2G2APLA2G1BPLA2G10PLA2G2E
SCHEMBL5865123 0.89 PLA2G2A (0.51) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL5864559 0.89 PLA2G2A (0.49) FABP4PLA2G2APLA2G1BPLA2G10PLA2G2E
SCHEMBL5864560 0.89 PLA2G2A (0.57) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL5864589 0.89 PLA2G2A (0.47) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL5864551 0.88 PLA2G2A (0.49) FABP4PLA2G2APLA2G1BPLA2G10PLA2G2E
SCHEMBL5864577 0.87 PLA2G2A (0.58) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL5864651 0.87 PLA2G2A (0.48) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL5864563 0.87 PLA2G2A (0.49) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109231-B2 Cyclohept[b]indole derivatives ELI LILLY AND COMPANY (US) 2006-09-19 US claimed
EP-1438290-B1 CYCLOHEPT B!INDOLE DERIVATIVES AS SPLA2 INHIBITORS LILLY CO ELI (US) 2005-12-14 EP claimed
US-20040198801-A1 Cyclohept'b!indole derivatives as spla2 inhibitors KINNICK MICHAEL DEAN (US) 2004-10-07 US claimed
EP-1438290-A1 CYCLOHEPT B!INDOLE DERIVATIVES AS SPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 2004-07-21 EP claimed
WO-2003016277-A1 CYCLOHEPT`B!INDOLE DERIVATIVES AS SPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 2003-02-27 WO claimed
US-7109231-B2 Cyclohept[b]indole derivatives ELI LILLY AND COMPANY (US) 2006-09-19 US disclosed
EP-1438290-B1 CYCLOHEPT B!INDOLE DERIVATIVES AS SPLA2 INHIBITORS LILLY CO ELI (US) 2005-12-14 EP disclosed
US-20040198801-A1 Cyclohept'b!indole derivatives as spla2 inhibitors KINNICK MICHAEL DEAN (US) 2004-10-07 US disclosed
EP-1438290-A1 CYCLOHEPT B!INDOLE DERIVATIVES AS SPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 2004-07-21 EP disclosed
WO-2003016277-A1 CYCLOHEPT`B!INDOLE DERIVATIVES AS SPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 2003-02-27 WO 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 (1 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-20040198801-A1 Cyclohept'b!indole derivatives as spla2 inhibitors SPTSSB, CPT1A, TPH2 FABP4 439/4885PLA2G2A 82/4885PLA2G1B 47/4885

“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.