SCHEMBL15420303

SCHEMBL15420303

O=C(O)N[C@H]1CCOC[C@@H]1COc1ccc(-n2cc(Cl)cn2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP46A1 Q9Y6A2 2/20 0.39
KCNH2 Q12809 2/20 0.37
GPR119 Q8TDV5 2/20 0.37
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
MAPK10 P53779 1/20 0.37
AXL P30530 5/20 0.36
MERTK Q12866 5/20 0.36
CHRM1 P11229 4/20 0.34
MELK Q14680 1/20 0.34
FFAR1 O14842 1/20 0.34
GRM5 P41594 1/20 0.34
RIPK2 O43353 1/20 0.34
HCRTR2 O43614 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
SCHEMBL15420531 0.91 SYK (0.39) MAPK8MAPK9MAPK10AXLMERTK
SCHEMBL15420023 0.89 GRM5 (0.35) CYP46A1KCNH2GPR119MAPK8MAPK9
SCHEMBL15420309 0.87 CYP46A1 (0.38) CYP46A1MAPK8MAPK9MAPK10CHRM1
SCHEMBL12989171 0.86 CHRM1 (0.40) CYP46A1AXLMERTKCHRM1RIPK2
SCHEMBL15420585 0.86 CHRM1 (0.40) CYP46A1AXLMERTKCHRM1RIPK2
SCHEMBL12989178 0.86 CHRM1 (0.40) CYP46A1AXLMERTKCHRM1RIPK2
SCHEMBL15420551 0.86 CYP46A1 (0.33) CYP46A1KCNH2GPR119MAPK8MAPK9
SCHEMBL15420692 0.86 CYP46A1 (0.33) CYP46A1KCNH2GPR119MAPK8MAPK9
SCHEMBL12990033 0.86 CYP46A1 (0.33) CYP46A1KCNH2GPR119MAPK8MAPK9
SCHEMBL15420479 0.85 CYP46A1 (0.38) CYP46A1MAPK8MAPK9MAPK10CHRM1

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 CYP46A1 1863/4885KCNH2 2363/4885GPR119 124/4885

“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.