SCHEMBL15420381

SCHEMBL15420381

CCc1cnn(-c2ccc(OCC3COCCC3NS(=O)(=O)C3CC3)cc2)c1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 3/20 0.35
HRH3 Q9Y5N1 1/20 0.34
RORC P51449 1/20 0.34
RIPK2 O43353 1/20 0.32
ACACB O00763 4/20 0.31
PDE1B Q01064 2/20 0.31
PDE1A P54750 1/20 0.31
PDE1C Q14123 1/20 0.31
EIF2AK4 Q9P2K8 1/20 0.31
MAPT P10636 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PIK3CA P42336 1/20 0.30

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
SCHEMBL15441649 1.00 CHRM1 (0.35) CHRM1HRH3RORCRIPK2ACACB
SCHEMBL15441641 0.91 CHRM1 (0.36) CHRM1HRH3RORCRIPK2ACACB
SCHEMBL15420040 0.91 CHRM1 (0.36) CHRM1HRH3RORCRIPK2ACACB
SCHEMBL15420067 0.91 CHRM1 (0.36) CHRM1HRH3RORCRIPK2ACACB
SCHEMBL15420375 0.91 CHRM1 (0.36) CHRM1HRH3RORCRIPK2ACACB
SCHEMBL15420400 0.91 CHRM1 (0.36) CHRM1HRH3RORCRIPK2ACACB
SCHEMBL15441158 0.89 KAT5 (0.38) CHRM1HRH3RIPK2ACACBPDE1B
SCHEMBL15420145 0.89 KAT5 (0.38) CHRM1HRH3RIPK2ACACBPDE1B
SCHEMBL15420247 0.89 MKNK1 (0.35) CHRM1HRH3RIPK2ACACBPDE1B
SCHEMBL15420726 0.88 HRH3 (0.33) CHRM1HRH3RIPK2ACACB

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 CHRM1 227/4885HRH3 1365/4885RORC 1197/4885

“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.