SCHEMBL4091407

SCHEMBL4091407

O=C(O)c1c(NC(=O)C2(c3ccccc3)CCCC2)sc2c1CCOC2

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.58
PTPN2 P17706 1/20 0.58
PTPN1 P18031 1/20 0.58
PTPRB P23467 1/20 0.58
PTPRE P23469 1/20 0.58
RAB7A P51149 2/20 0.58
ANO1 Q5XXA6 3/20 0.48
RAB9A P51151 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CXCR2 P25025 1/20 0.46
CNR2 P34972 9/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ESR2 Q92731 1/20 0.46

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
SCHEMBL4090883 0.99 RAB7A (0.57) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL4085581 0.90 PTPRC (0.54) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL4085480 0.86 PDE4D (0.55) ANO1MEN1KMT2AALDH1A1CXCR2
SCHEMBL4090095 0.86 CNR2 (0.63) RAB7AANO1CNR2POLBCNR1
SCHEMBL4090895 0.86 TLR2 (0.55) ANO1MEN1KMT2AALDH1A1CXCR2
SCHEMBL4090494 0.86 CNR2 (0.61) CNR2CNR1
SCHEMBL4094765 0.85 CNR2 (0.62) RAB7AANO1CNR2POLBCNR1
SCHEMBL4089799 0.80 PTPN1 (0.62) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL4083898 0.77 TLR2 (0.53) ANO1MEN1KMT2AALDH1A1CXCR2
SCHEMBL4090091 0.76 CNR2 (0.60) ANO1CNR2CNR1

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 PTPRC 1716/4885PTPN2 2430/4885PTPN1 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.