SCHEMBL2162140

SCHEMBL2162140

CCOc1ccccc1C(=O)Nc1sc2c(c1C(=O)C1CCC1)C(C)OC2

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
LMNA P02545 3/20 0.45
TP53 P04637 3/20 0.45
ALDH1A1 P00352 2/20 0.42
USP2 O75604 2/20 0.42
GAA P10253 2/20 0.41
MAPK1 P28482 2/20 0.41
KMT2A Q03164 3/20 0.40
ALOX15 P16050 1/20 0.40
MEN1 O00255 2/20 0.40
BRPF1 P55201 1/20 0.40
HPGD P15428 1/20 0.39

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
SCHEMBL2162482 0.87 CNR2 (0.52) KMT2A
SCHEMBL2162492 0.78 NPC1 (0.42) MAPTTP53KMT2AMEN1
SCHEMBL2162128 0.74 CNR2 (0.44) MAPTALDH1A1KMT2AMEN1HPGD
SCHEMBL2162358 0.73 CNR2 (0.50) MAPTGAAHPGD
SCHEMBL2162159 0.72 CNR2 (0.49) MAPTLMNATP53ALDH1A1USP2
SCHEMBL2162421 0.71 CNR2 (0.50) MAPTGAAHPGD
SCHEMBL2163174 0.70 CNR1 (0.37) MAPTLMNAALDH1A1GAAKMT2A
SCHEMBL2162704 0.69 MAPT (0.50) MAPTLMNATP53ALDH1A1USP2
SCHEMBL4842211 0.68 MEN1 (0.50) MAPTLMNATP53ALDH1A1KMT2A
SCHEMBL2163243 0.68 CXCR2 (0.49) MAPTLMNATP53ALDH1A1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7985768-B2 2-carbonylamino-4,6-dihydrothieno[2,3-c]furans such as ethyl 2-{[2-fluoro-6-(trifluoromethyl)benzoyl]amino}-4-methyl-4,6-dihydrothieno[2,3-c]furan-3-carboxylate; CB2 receptors ligands for immune and inflammatory conditions; pain; neuroprotectants ABBOTT LABORATORIES (US) 2011-07-26 US claimed
WO-2008028094-A1 COMPOUNDS AS CB2 CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2008-03-06 WO claimed
US-20080058308-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2008-03-06 US claimed
US-7985768-B2 2-carbonylamino-4,6-dihydrothieno[2,3-c]furans such as ethyl 2-{[2-fluoro-6-(trifluoromethyl)benzoyl]amino}-4-methyl-4,6-dihydrothieno[2,3-c]furan-3-carboxylate; CB2 receptors ligands for immune and inflammatory conditions; pain; neuroprotectants ABBOTT LABORATORIES (US) 2011-07-26 US disclosed
US-20080058308-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2008-03-06 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-20080058308-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, OPRL1 MAPT 1751/4885LMNA 4225/4885TP53 4614/4885

“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.