SCHEMBL15420679

SCHEMBL15420679

CCCS(=O)(=O)NC1CCOCC1COc1ccc(-c2coc(C)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 9/20 0.44
THRB P10828 3/20 0.44
POLB P06746 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
MAPT P10636 1/20 0.40
ENPP3 O14638 2/20 0.39
ENPP1 P22413 1/20 0.39
KAT7 O95251 1/20 0.36
KAT5 Q92993 1/20 0.36
KAT8 Q9H7Z6 1/20 0.36
XDH P47989 1/20 0.36
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
KMT2A Q03164 1/20 0.35
CHRM1 P11229 1/20 0.34

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
SCHEMBL15441138 1.00 TP53 (0.44) TP53THRBPOLBTDP1MAPT
SCHEMBL15441636 0.94 TP53 (0.46) TP53THRBPOLBTDP1MAPT
SCHEMBL15420013 0.94 TP53 (0.46) TP53THRBPOLBTDP1MAPT
SCHEMBL15420643 0.88 TP53 (0.41) TP53THRBPOLBTDP1MAPT
SCHEMBL15441378 0.88 TP53 (0.41) TP53THRBPOLBTDP1MAPT
SCHEMBL15420721 0.86 TP53 (0.46) TP53THRBPOLBTDP1MAPT
SCHEMBL12988475 0.84 CYP1A2 (0.43) XDH
SCHEMBL15441519 0.84 CYP1A2 (0.43) XDH
SCHEMBL13192658 0.82 GRIA2 (0.36) XDHNPC1
SCHEMBL15420806 0.81 TP53 (0.44) TP53THRBPOLBTDP1MAPT

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 TP53 2416/4885THRB 686/4885POLB 3654/4885

“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.