SCHEMBL2163131

SCHEMBL2163131

CC1OCc2sc(NC(=O)c3c(C(F)(F)F)ccc(Cl)c3F)c(C(=O)O)c21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.40
CNR1 P21554 9/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
TNF P01375 2/20 0.37
NOD1 Q9Y239 2/20 0.37
ANO1 Q5XXA6 1/20 0.37
RAB7A P51149 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL2163283 0.91 CNR2 (0.39) CNR2CNR1MEN1KMT2AANO1
SCHEMBL2162462 0.87 CXCR2 (0.42) CNR2CNR1MEN1KMT2AKDM4E
SCHEMBL2162083 0.86 CNR1 (0.59) CNR2CNR1
SCHEMBL2162342 0.85 CNR2 (0.52) CNR2CNR1MEN1KMT2ARAB7A
SCHEMBL2162084 0.85 ANO1 (0.54) CNR2CNR1MEN1KMT2ATNF
SCHEMBL2162079 0.84 CNR2 (0.56) CNR2CNR1
SCHEMBL2162337 0.81 CNR2 (0.54) CNR2CNR1MEN1KMT2ATNF
SCHEMBL2162081 0.77 CNR2 (0.50) CNR2CNR1RAB7A
SCHEMBL2162613 0.76 CNR2 (0.51) CNR2CNR1
SCHEMBL2162421 0.74 CNR2 (0.50) CNR2CNR1KDM4EMAPT

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-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 CNR2 2/4885CNR1 1/4885MEN1 2994/4885

“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.