SCHEMBL15420780

SCHEMBL15420780

Cc1nn(-c2ccc(OC[C@H]3COCC[C@@H]3NC(=O)O)cc2)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCG P01275 1/20 0.38
CHRM1 P11229 4/20 0.36
FFAR4 Q5NUL3 3/20 0.36
DGAT1 O75907 1/20 0.35
AXL P30530 3/20 0.34
MERTK Q12866 3/20 0.34
ACACB O00763 3/20 0.34
DDX3X O00571 1/20 0.34
PDE2A O00408 1/20 0.33
PDE10A Q9Y233 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
SCHEMBL15420816 0.86 PDE2A (0.34) GCGCHRM1FFAR4ACACBDDX3X
SCHEMBL12989178 0.84 CHRM1 (0.40) CHRM1FFAR4AXLMERTK
SCHEMBL15420585 0.84 CHRM1 (0.40) CHRM1FFAR4AXLMERTK
SCHEMBL12989171 0.84 CHRM1 (0.40) CHRM1FFAR4AXLMERTK
SCHEMBL15420757 0.84 DDB1 (0.41) CHRM1FFAR4ACACB
SCHEMBL12989884 0.83 CHRM1 (0.42) CHRM1AXLMERTKACACBDDX3X
SCHEMBL12989883 0.83 CHRM1 (0.42) CHRM1AXLMERTKACACBDDX3X
SCHEMBL21795642 0.83 GCG (0.34) GCGFFAR4DGAT1AXLMERTK
SCHEMBL15420612 0.79 GCGR (0.44) GCGCHRM1FFAR4
SCHEMBL15420716 0.77 CHRM1 (0.39) CHRM1FFAR4AXLMERTK

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-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 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-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF GRIN2A, GRIN2B, SLC1A2 GCG 4793/4885CHRM1 227/4885FFAR4 277/4885

“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.