SCHEMBL15420465

SCHEMBL15420465

O=C(O)N[C@H]1CCOC[C@@H]1COc1ccc(-c2ccc(F)cn2)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.38
NTRK1 P04629 5/20 0.37
GRM5 P41594 3/20 0.36
AXL P30530 2/20 0.35
MERTK Q12866 2/20 0.35
GRM4 Q14833 4/20 0.34
HCRTR2 O43614 1/20 0.33
DGAT2 Q96PD7 1/20 0.33
PDE9A O76083 1/20 0.33
FFAR1 O14842 1/20 0.32
CYP2C8 P10632 1/20 0.32
FGFR4 P22455 1/20 0.32

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
SCHEMBL12987085 0.84 SMO (0.41) DGAT1GRM5AXLMERTKHCRTR2
SCHEMBL15420348 0.84 GRM5 (0.41) DGAT1NTRK1GRM5GRM4FFAR1
SCHEMBL12987814 0.84 GRIA2 (0.36) DGAT1NTRK1GRM5AXLMERTK
SCHEMBL15420322 0.82 GRM5 (0.41) DGAT1NTRK1GRM5GRM4FFAR1
SCHEMBL15420480 0.77 FFAR4 (0.40) DGAT1GRM5AXLMERTKGRM4
SCHEMBL15420619 0.76 FFAR4 (0.41) DGAT1GRM4
SCHEMBL15420401 0.76 KCNH2 (0.38) DGAT1NTRK1GRM5GRM4FFAR1
SCHEMBL15420479 0.75 CYP46A1 (0.38) HCRTR2
SCHEMBL15420166 0.75 CHRM1 (0.40) HCRTR2
SCHEMBL15420045 0.74 GRM5 (0.39) GRM5DGAT2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2694472-B1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2020-03-11 EP disclosed
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 DGAT1 2937/4885NTRK1 1606/4885GRM5 9/4885

“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.