SCHEMBL1993635

SCHEMBL1993635

CC(NC(=O)c1cc(F)cc(NS(=O)(=O)CC2CN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)C2)c1)c1ccccn1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
WDR5 P61964 1/20 0.36
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
BACE1 P56817 3/20 0.35
BACE2 Q9Y5Z0 1/20 0.35
ACKR3 P25106 1/20 0.35
CNR2 P34972 2/20 0.35
DRD2 P14416 1/20 0.35
PPARG P37231 1/20 0.35
SCN9A Q15858 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
SCHEMBL1989763 0.88 CYP3A4 (0.38) FNTAFNTBBACE1BACE2SCN9A
SCHEMBL1988741 0.87 CYP3A4 (0.43) FNTAFNTBBACE1BACE2
SCHEMBL1991869 0.85 NPC1 (0.38) BACE1BACE2SCN9A
SCHEMBL1993928 0.85 ALDH1A1 (0.44) L3MBTL1ACKR3
SCHEMBL977155 0.84 SLC6A9 (0.38) BACE1BACE2SCN9A
SCHEMBL977153 0.84 SLC6A9 (0.38) BACE1BACE2SCN9A
SCHEMBL1988811 0.84 RAB9A (0.39) BACE1BACE2
SCHEMBL974839 0.84 SCN9A (0.35) BACE1BACE2SCN9A
SCHEMBL974741 0.84 SCN9A (0.35) BACE1BACE2SCN9A
SCHEMBL977431 0.84 SCN9A (0.38) BACE1BACE2SCN9A

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 CNR1 16/4885L3MBTL1 4593/4885WDR5 3775/4885

“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.