SCHEMBL927488

SCHEMBL927488

CCOC(=O)c1c(NC(=O)c2cc(Cl)ccc2C(F)(F)F)sc2c1CC1CCC2O1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 1/20 0.41
HPGD P15428 8/20 0.41
MAPT P10636 7/20 0.41
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 4/20 0.41
TDP1 Q9NUW8 2/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HSD17B10 Q99714 2/20 0.39
USP2 O75604 1/20 0.39
TSHR P16473 1/20 0.39
CASP1 P29466 1/20 0.39
TP53 P04637 2/20 0.39
THRB P10828 1/20 0.39
NPSR1 Q6W5P4 3/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL927272 0.89 MAPT (0.47) HPGDMAPTALDH1A1KDM4ETDP1
SCHEMBL926837 0.87 THRB (0.41) HPGDMAPTALDH1A1KDM4ETDP1
SCHEMBL927449 0.83 CNR2 (0.44) HPGDMAPTALDH1A1KDM4ETP53
SCHEMBL926847 0.83 CNR2 (0.46) HPGDMAPTALDH1A1KDM4ETDP1
SCHEMBL928719 0.77 CNR2 (0.46) HPGDMAPTKDM4ETDP1HSD17B10
SCHEMBL4794563 0.76 CNR2 (0.45) HPGDMAPTALDH1A1LMNAL3MBTL1
SCHEMBL2162606 0.75 ANO1 (0.43) ANO1HPGDMAPTALDH1A1KDM4E
SCHEMBL926977 0.74 KMT2A (0.48) HPGDMAPTALDH1A1KDM4ETDP1
SCHEMBL18300332 0.74 KMT2A (0.58) MAPTALDH1A1KDM4ETDP1LMNA
SCHEMBL2163850 0.73 ANO1 (0.44) ANO1HPGDMAPTALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868038-B2 Compounds as cannabinoid receptor ligands ABBOTT LABORATORIES (US) 2011-01-11 US claimed
US-20080058307-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2008-03-06 US claimed
US-8598224-B2 Method for treating cannabinoid receptor related diseases with cannabinoid receptor ligands ABBVIE INC. (US) 2013-12-03 US disclosed
US-20110086838-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2011-04-14 US disclosed
US-7868038-B2 Compounds as cannabinoid receptor ligands ABBOTT LABORATORIES (US) 2011-01-11 US disclosed
US-20080058307-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 (2 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-20080058307-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, NPSR1 ANO1 3840/4885HPGD 3098/4885MAPT 2116/4885
US-20110086838-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, NPSR1 ANO1 3840/4885HPGD 3098/4885MAPT 2116/4885

“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.