SCHEMBL344910

SCHEMBL344910

CS(=O)(=O)Cc1ccc(F)nc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
NFE2L2 Q16236 1/20 0.37
MMP2 P08253 2/20 0.36
MMP9 P14780 2/20 0.36
MMP8 P22894 2/20 0.36
MMP13 P45452 2/20 0.36
HTR2A P28223 1/20 0.36
KCNH2 Q12809 1/20 0.36
GSK3A P49840 1/20 0.33
CDK9 P50750 1/20 0.33
IRAK1 P51617 1/20 0.33
CSF1R P07333 1/20 0.33
CNR1 P21554 1/20 0.32
HDAC1 Q13547 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32

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
SCHEMBL30096932 0.81 CA2 (0.45) CYP11B1CYP11B2NFE2L2MMP2MMP9
SCHEMBL29271395 0.80 NFE2L2 (0.40) CYP11B1CYP11B2NFE2L2MMP2MMP9
SCHEMBL12147832 0.78 TSHR (0.42) HDAC1
SCHEMBL30316134 0.78 GABRP (0.52)
SCHEMBL29814681 0.77 ALDH1A1 (0.49)
SCHEMBL28176537 0.77 CYP11B1 (0.40) CYP11B1MMP2MMP9MMP8MMP13
SCHEMBL1697611 0.77 ALDH1A1 (0.49)
SCHEMBL2116479 0.77 NFE2L2 (0.38) CYP11B1CYP11B2NFE2L2MMP2MMP9
SCHEMBL23114318 0.74 CHRNA7 (0.40) KCNH2
SCHEMBL777188 0.73 KMT2A (0.44)

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-8338467-B2 Compounds as cannabinoid receptor ligands ABBVIE INC. (US) 2012-12-25 US disclosed
US-20120015929-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2012-01-19 US disclosed
US-8058293-B2 Compounds as cannabinoid receptor ligands ABBOTT LABORATORIES (US) 2011-11-15 US disclosed
EP-2274306-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS Abbott Laboratories (US) 2011-01-19 EP disclosed
US-20090247500-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-10-01 US disclosed
WO-2009114566-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-09-17 WO 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-20120015929-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, OPRL1 CYP11B1 1179/4885CYP11B2 1298/4885NFE2L2 4335/4885
US-20090247500-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, OPRL1 CYP11B1 1179/4885CYP11B2 1298/4885NFE2L2 4335/4885

“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.