SCHEMBL1990276

SCHEMBL1990276

Cc1cccc(NC(=O)c2cc(F)cc(N(C3CN(C(c4ccc(Cl)cc4)c4ccc(Cl)cc4)C3)S(C)(=O)=O)c2)n1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.50
CYP3A4 P08684 2/20 0.41
SORT1 Q99523 1/20 0.38
KMT2A Q03164 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
SCHEMBL1989636 0.88 SMN1; SMN2 (0.42) KMT2A
SCHEMBL1993913 0.86 ALDH1A1 (0.37) GRM5KMT2A
SCHEMBL1988820 0.86 RAB9A (0.45) KMT2A
SCHEMBL1550616 0.86 FFAR2 (0.37) CYP3A4KMT2A
SCHEMBL1987375 0.86 GRM5 (0.47) GRM5CYP3A4KMT2A
SCHEMBL1997351 0.86 NPC1 (0.41) GRM5KMT2A
SCHEMBL1994776 0.85 F2 (0.35) GRM5
SCHEMBL1990100 0.85 F2 (0.36) GRM5
SCHEMBL1988375 0.85 FFAR2 (0.39) KMT2A
SCHEMBL1989363 0.85 KMT2A (0.40) CYP3A4KMT2A

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 GRM5 4012/4885CYP3A4 846/4885SORT1 1476/4885

“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.