SCHEMBL20588293

SCHEMBL20588293

CCOC(=O)c1cnc2nc(S(C)(=O)=O)ncc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.55
NPC1 O15118 1/20 0.55
ALDH1A1 P00352 1/20 0.55
TP53 P04637 1/20 0.55
XBP1 P17861 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
HSD17B10 Q99714 1/20 0.55
TLR9 Q9NR96 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.46
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
MAOB P27338 3/20 0.42
HPGD P15428 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
RECQL P46063 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL650818 0.81 HTT (0.60) MAPTNPC1ALDH1A1TP53XBP1
SCHEMBL21945719 0.80 CYP2C9 (0.47) MAPTNPC1ALDH1A1HSD17B10CYP2C9
SCHEMBL20589650 0.77 MEN1 (0.48) MAPTALDH1A1MAPK1HTTCYP2C9
SCHEMBL21946030 0.77 CYP2C9 (0.44) MAPTNPC1ALDH1A1L3MBTL1CYP2C9
SCHEMBL20588963 0.75 HPGDS (0.52) MAPTHSD17B10CYP2C9CYP2C19MAOB
SCHEMBL20589420 0.75 CYP2C9 (0.43) NPC1CYP2C9CYP2C19MAOBMEN1
SCHEMBL4763594 0.75 MAPT (0.63) MAPTNPC1ALDH1A1TP53XBP1
SCHEMBL20589348 0.74 MAOB (0.50) NPC1CYP2C9CYP2C19MAOBMEN1
SCHEMBL21853643 0.73 MAOB (0.49) MAPTNPC1ALDH1A1L3MBTL1CYP2C9
SCHEMBL20588279 0.73 MAOB (0.49) MAPTNPC1ALDH1A1TP53NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11149035-B2 Chemical compounds as H—PGDS inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DFVELOPMENT LIMITED (GB) 2021-10-19 US disclosed
US-11149035-B2 Chemical compounds as H—PGDS inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DFVELOPMENT LIMITED (GB) 2021-10-19 US disclosed
US-20200123152-A1 Chemical Compounds as H-PGDS Inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-04-23 US disclosed
US-20200123152-A1 Chemical Compounds as H-PGDS Inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-04-23 US disclosed
EP-3638672-A1 CHEMICAL COMPOUNDS AS H-PGDS INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-04-22 EP disclosed
WO-2018229629-A1 CHEMICAL COMPOUNDS AS H-PGDS INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-12-20 WO 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 (2 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-11149035-B2 Chemical compounds as H—PGDS inhibitors HPGDS, PTGS1, PTGIS MAPT 4769/4885NPC1 3442/4885ALDH1A1 918/4885
US-20200123152-A1 Chemical Compounds as H-PGDS Inhibitors HPGDS, PTGS1, PTGIS MAPT 4760/4885NPC1 3379/4885ALDH1A1 889/4885

“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.