SCHEMBL1990476

SCHEMBL1990476

CS(=O)(=O)N(c1cc(F)cc(C(=O)NCc2ccc(=O)[nH]c2)c1)C1CN(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.40
EPHX2 P34913 3/20 0.38
HRH3 Q9Y5N1 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
DDR1 Q08345 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ROCK2 O75116 1/20 0.34
NNMT P40261 1/20 0.34
SNCA P37840 1/20 0.33
KCNH2 Q12809 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL1551573 0.87 SMN1; SMN2 (0.43) F2HRH3MEN1KMT2ARAB9A
SCHEMBL1990733 0.85 F2 (0.38) F2HRH3MEN1KMT2ARAB9A
SCHEMBL1551280 0.85 LMNA (0.46) KMT2ASMN1; SMN2LMNA
SCHEMBL976717 0.85 F2 (0.39) F2HRH3MEN1KMT2ARAB9A
SCHEMBL3401787 0.85 F2 (0.39) F2HRH3MEN1KMT2ARAB9A
SCHEMBL3406126 0.83 F2 (0.38) F2HRH3DDR1LMNATP53
SCHEMBL3655106 0.83 F2 (0.38) F2EPHX2HRH3KMT2ADDR1
SCHEMBL3661828 0.83 F2 (0.37) F2HRH3DDR1LMNATP53
SCHEMBL977990 0.83 F2 (0.37) F2MEN1KMT2ARAB9ADDR1
SCHEMBL3662481 0.83 F2 (0.37) F2EPHX2KMT2ADDR1TP53

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 F2 1930/4885EPHX2 906/4885HRH3 21/4885

“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.