SCHEMBL4090461

SCHEMBL4090461

CC1(C)C(C(=O)Nc2sc3c(c2C(=O)O)CCOC3)C1(C)C

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.70
PTPN1 P18031 2/20 0.68
PTPRC P08575 1/20 0.68
PTPN2 P17706 1/20 0.68
PTPRB P23467 1/20 0.68
PTPRE P23469 1/20 0.68
RAB7A P51149 1/20 0.55
CFTR P13569 1/20 0.48
CNR1 P21554 3/20 0.46
CXCR2 P25025 1/20 0.45
ANO1 Q5XXA6 1/20 0.45
KMT2A Q03164 1/20 0.44
NOD1 Q9Y239 1/20 0.44

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
SCHEMBL5455938 0.89 CNR2 (0.69) CNR2PTPN1PTPRCPTPN2PTPRB
SCHEMBL4080680 0.85 PTPN1 (0.59) CNR2PTPN1PTPRCPTPN2PTPRB
SCHEMBL4094482 0.84 CNR2 (0.84) CNR2PTPN1PTPRCPTPN2PTPRB
SCHEMBL5453432 0.84 PTPN1 (0.71) CNR2PTPN1PTPRCPTPN2PTPRB
SCHEMBL4090404 0.84 CNR2 (0.66) CNR2PTPN1PTPRCPTPN2PTPRB
SCHEMBL4080930 0.83 CNR2 (0.69) CNR2CNR1KMT2A
SCHEMBL4086799 0.83 PTPN1 (0.63) PTPN1PTPRCPTPN2PTPRBPTPRE
SCHEMBL4091622 0.83 PTPN1 (0.63) PTPN1PTPRCPTPN2PTPRBPTPRE
SCHEMBL4094976 0.83 CNR2 (1.00) CNR2PTPN1PTPRCPTPN2PTPRB
SCHEMBL4087139 0.83 CNR2 (0.84) CNR2PTPN1PTPRCPTPN2PTPRB

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 CNR2 2/4885PTPN1 2348/4885PTPRC 1716/4885

“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.