SCHEMBL4095531

SCHEMBL4095531

CCCNC(=O)c1cc(-c2ccccc2)sc1NC(=O)C1C(C)(C)C1(C)C

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 8/20 0.65
CHEK1 O14757 7/20 0.58
MAP4K4 O95819 1/20 0.50
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
PTPN5 P54829 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CNR2 P34972 1/20 0.47

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
SCHEMBL3743125 0.83 NPC1 (0.64) CHEK1MAP4K4NPC1MAPTRAB9A
SCHEMBL3812791 0.81 ALDH1A1 (0.71) ALOX15MAPTRAB9ANPSR1CNR2
SCHEMBL4080887 0.78 ALOX15 (0.57) ALOX15CHEK1CNR2
SCHEMBL3804151 0.78 ALOX15 (0.57) ALOX15CHEK1CNR2
SCHEMBL4096330 0.76 CNR2 (0.48) CNR2
SCHEMBL1564746 0.73 CHEK1 (1.00) ALOX15CHEK1MAP4K4
SCHEMBL1564586 0.73 CHEK1 (1.00) ALOX15CHEK1MAP4K4
SCHEMBL4086750 0.73 CNR2 (0.53) NPC1MAPTRAB9ACNR2
SCHEMBL1563875 0.72 CHEK1 (1.00) ALOX15CHEK1MAP4K4
SCHEMBL30286125 0.69 ALOX15 (1.00) ALOX15CHEK1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338623-B2 N-{3-[(2,5-dimethylmorpholin-4-yl)carbonyl]-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl}hexahydro-2,5-methanopentalene-3a(1H)-carboxamide; CB2 receptors ligand; antiinflammatory, analgesic agent; autoimmune diseases; neuroprotectants ABBVIE INC. (US) 2012-12-25 US disclosed
US-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-01-15 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-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, GPR18 ALOX15 1251/4885CHEK1 2624/4885MAP4K4 2010/4885

“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.