SCHEMBL4083980

SCHEMBL4083980

Nc1sc2c(c1C(=O)Nc1ccccc1)CCOC2

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 5/20 0.53
ALOX15 P16050 1/20 0.52
ALOX12 P18054 1/20 0.52
CXCR2 P25025 1/20 0.52
RAB7A P51149 1/20 0.51
MAPT P10636 2/20 0.48
CFTR P13569 1/20 0.47
PTPRC P08575 1/20 0.47
PTPN2 P17706 1/20 0.47
PTPN1 P18031 1/20 0.47
PTPRB P23467 1/20 0.47
PTPRE P23469 1/20 0.47
CNR2 P34972 5/20 0.47
CNR1 P21554 4/20 0.47
ADORA1 P30542 1/20 0.47
TAAR1 Q96RJ0 2/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL17529373 0.88 TAAR1 (0.53) ANO1ALOX15ALOX12CXCR2RAB7A
SCHEMBL20339091 0.88 ANO1 (0.56) ANO1ALOX15ALOX12CXCR2RAB7A
SCHEMBL16681664 0.82 ALOX15 (0.73) ANO1ALOX15ALOX12MAPTTAAR1
SCHEMBL4055676 0.82 ALDH1A1 (0.66) ANO1RAB7AMAPTCFTRPTPRC
SCHEMBL15997243 0.79 MAPT (0.49) ANO1CXCR2MAPTCFTRTAAR1
SCHEMBL4090404 0.78 CNR2 (0.66) ANO1CXCR2RAB7ACFTRPTPRC
SCHEMBL3500340 0.78 PTPRC (0.58) ANO1ALOX15RAB7AMAPTCFTR
SCHEMBL5455947 0.77 MEN1 (0.65) ANO1CXCR2RAB7AMAPTCFTR
SCHEMBL13738436 0.76 ADORA1 (0.58) ALOX15ALOX12MAPTADORA1TAAR1
SCHEMBL3452996 0.75 ALDH1A1 (0.60) ANO1ALOX15RAB7AMAPTCFTR

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 ANO1 3284/4885ALOX15 1251/4885ALOX12 990/4885

“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.