SCHEMBL5864679

SCHEMBL5864679

COC(=O)C1CCCCC(=O)C1=O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MCL1 Q07820 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
TSHR P16473 3/20 0.34
CYP1A2 P05177 1/20 0.34
HIF1A Q16665 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 3/20 0.33
HTT P42858 2/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
THRB P10828 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33

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
SCHEMBL11215361 0.98 KDM4E (0.40) MAPK1KDM4EHSD17B10MCL1SMN1; SMN2
SCHEMBL15475264 0.94 THRB (0.38) MAPK1KDM4EHSD17B10TSHRCYP1A2
SCHEMBL15415222 0.81 KDM4E (0.40) MAPK1KDM4EHSD17B10MCL1SMN1; SMN2
SCHEMBL3171 0.81 MAPK1 (0.54) MAPK1KDM4EHSD17B10MCL1SMN1; SMN2
SCHEMBL7305358 0.81 MAPK1 (0.54) MAPK1KDM4EHSD17B10MCL1SMN1; SMN2
SCHEMBL20303983 0.81 MAPK1 (0.54) MAPK1KDM4EHSD17B10MCL1SMN1; SMN2
SCHEMBL1615850 0.79 MAPK1 (0.53) MAPK1KDM4EHSD17B10MCL1SMN1; SMN2
SCHEMBL7199566 0.79 MAPK1 (0.53) MAPK1KDM4EHSD17B10MCL1SMN1; SMN2
SCHEMBL3767660 0.79 MAPK1 (0.53) MAPK1KDM4EHSD17B10MCL1SMN1; SMN2
SCHEMBL6248372 0.79 MAPK1 (0.53) MAPK1KDM4EHSD17B10MCL1SMN1; SMN2

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-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

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 MAPK1 4341/4885KDM4E 3426/4885HSD17B10 134/4885

“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.