SCHEMBL1993582

SCHEMBL1993582

CS(=O)(=O)N(c1cccc(C(=O)Nc2ccc(N)nc2)c1)C1CN(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 3/20 0.39
KCNQ2 O43526 3/20 0.39
KCNE1 P15382 2/20 0.39
KCNQ1 P51787 2/20 0.39
SIRT2 Q8IXJ6 5/20 0.38
KDR P35968 2/20 0.38
KIT P10721 2/20 0.38
MAPK14 Q16539 1/20 0.38
EGFR P00533 1/20 0.37
FGFR1 P11362 1/20 0.37
MAPK10 P53779 1/20 0.37
RAB9A P51151 3/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
NPC1 O15118 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
NFKB1 P19838 1/20 0.37
STAT3 P40763 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL1990504 0.85 FFAR2 (0.39) SIRT2KDREGFRFGFR1RAB9A
SCHEMBL1989681 0.84 TSHR (0.45) RAB9AMEN1KMT2ANPC1HTT
SCHEMBL1987379 0.82 MEN1 (0.36) SIRT2KDREGFRFGFR1RAB9A
SCHEMBL1996083 0.82 GRM5 (0.40) SIRT2RAB9AMEN1KMT2ANPC1
SCHEMBL1989432 0.82 KMT2A (0.36) SIRT2RAB9AMEN1KMT2ANPC1
SCHEMBL1551291 0.82 MEN1 (0.47) RAB9AMEN1KMT2ANPC1ALDH1A1
SCHEMBL1990889 0.81 NPC1 (0.37) SIRT2KDREGFRFGFR1RAB9A
SCHEMBL1990300 0.81 SMN1; SMN2 (0.49) SIRT2RAB9AMEN1KMT2ANPC1
SCHEMBL976386 0.80 CTSD (0.39) TDP1TSHR
SCHEMBL976518 0.80 CTSD (0.39) TDP1TSHR

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-20110152236-A1 AZETIDINE POLYSUBSTITUTED COMPOUNDS, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2011-06-23 US claimed
US-20110152236-A1 AZETIDINE POLYSUBSTITUTED COMPOUNDS, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2011-06-23 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-20110152236-A1 AZETIDINE POLYSUBSTITUTED COMPOUNDS, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF C1R, TACR1, C1S KCNQ3 482/4885KCNQ2 803/4885KCNE1 756/4885

“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.