SCHEMBL2162148

SCHEMBL2162148

CCOC(=O)c1c(NC(=O)C2CC3CCC2(OC)CC3)sc2c1C(C)(C)OC2(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 8/20 0.39
MAPT P10636 4/20 0.39
HPGD P15428 3/20 0.39
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 7/20 0.38
POLB P06746 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 4/20 0.37
MEN1 O00255 1/20 0.37
THRB P10828 1/20 0.37
RPS6KB1 P23443 1/20 0.36
CDK2 P24941 1/20 0.36
MAPKAPK2 P49137 1/20 0.36
GSK3B P49841 1/20 0.36
RPS6KA3 P51812 1/20 0.36
CNR1 P21554 1/20 0.36

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
SCHEMBL4091037 0.79 MAPT (0.50) KMT2AALDH1A1MAPTHPGDMAPK1
SCHEMBL2162614 0.79 RPS6KB1 (0.54) KMT2AALDH1A1MAPTHPGDMAPK1
SCHEMBL16817380 0.76 ALDH1A1 (0.54) KMT2AALDH1A1MAPTHPGDMAPK1
SCHEMBL2162468 0.74 CNR2 (0.43) KMT2AALDH1A1MAPTHPGDMAPK1
SCHEMBL2162471 0.74 CNR2 (0.43) KMT2AALDH1A1MAPTHPGDMAPK1
SCHEMBL4090349 0.74 CNR2 (0.48) KMT2ACNR1CNR2
SCHEMBL4852376 0.70
SCHEMBL2162092 0.66 ALDH1A1 (0.57) KMT2AALDH1A1MAPTHPGDMAPK1
SCHEMBL4091336 0.64 RPS6KB1 (0.52) KMT2AALDH1A1MAPTHPGDMAPK1
SCHEMBL2162130 0.64 CNR2 (0.48) ALDH1A1MAPTHPGDMAPK1KDM4E

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
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
WO-2008028094-A1 COMPOUNDS AS CB2 CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2008-03-06 WO 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 KMT2A 2756/4885ALDH1A1 1497/4885MAPT 1751/4885

“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.