SCHEMBL4084873

SCHEMBL4084873

O=C(O)c1c(NC(=O)C23CC4CC(CC(C4)O2)C3)sc2c1CCCC2

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.58
CNR1 P21554 4/20 0.54
PTPN1 P18031 3/20 0.53
PTPRC P08575 1/20 0.53
PTPN2 P17706 1/20 0.53
PTPRB P23467 1/20 0.53
PTPRE P23469 1/20 0.53
PTPN6 P29350 1/20 0.53
ABCC1 P33527 2/20 0.53
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
TNF P01375 1/20 0.52
NOD1 Q9Y239 1/20 0.52
GLO1 Q04760 1/20 0.51
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
GRIN2C Q14957 1/20 0.49
GAA P10253 1/20 0.49
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL4091610 0.87 CNR2 (0.75) CNR2CNR1PTPN1PTPRCPTPN2
SCHEMBL4085851 0.85 CNR2 (0.77) CNR2CNR1GAAALDH1A1LMNA
SCHEMBL4085627 0.84 CNR2 (0.76) CNR2CNR1KMT2AGAAALDH1A1
SCHEMBL4090110 0.84 CNR2 (0.59) CNR2CNR1ALDH1A1
SCHEMBL3640627 0.80 CNR2 (0.70) CNR2CNR1PTPN1PTPRCPTPN2
SCHEMBL2162069 0.79 CNR2 (0.50) CNR2CNR1ALDH1A1LMNAHPGD
SCHEMBL4091403 0.79 CNR2 (0.69) CNR2CNR1PTPN1PTPRCPTPN2
SCHEMBL4086532 0.79 CNR2 (0.69) CNR2CNR1PTPN1PTPRCPTPN2
SCHEMBL3799308 0.74 CNR2 (0.74) CNR2CNR1MEN1KMT2ARAB9A
SCHEMBL4081101 0.74 CNR2 (0.73) CNR2CNR1KMT2AGAAALDH1A1

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 2/4885CNR1 1/4885PTPN1 2348/4885

“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.