SCHEMBL4635631

SCHEMBL4635631

COC(=O)C(O)c1c(C)c(S(=O)(=O)c2ccc(Cl)cc2)c2ccccn12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 3/20 0.40
PTGDR2 Q9Y5Y4 3/20 0.40
SMN1; SMN2 Q16637 5/20 0.38
MAPT P10636 5/20 0.38
TP53 P04637 3/20 0.38
ALDH1A1 P00352 6/20 0.38
GAA P10253 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HPGD P15428 3/20 0.37
KDM4E B2RXH2 3/20 0.37
HTR1A P08908 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 1/20 0.37
HTR6 P50406 1/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NOD2 Q9HC29 1/20 0.37
NOD1 Q9Y239 1/20 0.37
NR3C2 P08235 1/20 0.37
MEN1 O00255 3/20 0.36

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
SCHEMBL4635350 0.89 HTR6 (0.41) SMN1; SMN2MAPTALDH1A1GAAHPGD
SCHEMBL4636941 0.79 ALDH1A1 (0.42) AKR1B1PTGDR2SMN1; SMN2MAPTTP53
SCHEMBL4636277 0.78 HCRTR1 (0.43) AKR1B1PTGDR2SMN1; SMN2MAPTALDH1A1
SCHEMBL4635639 0.74 HCRTR1 (0.47) AKR1B1PTGDR2MAPTALDH1A1GAA
SCHEMBL4635361 0.72 ALDH1A1 (0.46) SMN1; SMN2MAPTALDH1A1GAAL3MBTL1
SCHEMBL2591733 0.70 HCRTR2 (0.55) SMN1; SMN2MAPTALDH1A1GAAL3MBTL1
SCHEMBL4636242 0.68 MAPT (0.45) SMN1; SMN2MAPTALDH1A1L3MBTL1HPGD
SCHEMBL4635636 0.67 HCRTR1 (0.52) PTGDR2SMN1; SMN2MAPTALDH1A1GAA
SCHEMBL2770132 0.65 ABCB1 (0.44) AKR1B1PTGDR2ALDH1A1GAAL3MBTL1
SCHEMBL4635730 0.65 ALDH1A1 (0.43) AKR1B1PTGDR2SMN1; SMN2MAPTALDH1A1

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
US-20080306109-A1 Indolizine Derivatives as Ligands of the Crth2 Receptor ARGENTA DISCOVERY LIMITED (GB) 2008-12-11 US disclosed
EP-1931663-A1 IMDOLIZINE DERIVATIVES AS LIGANDS OF THE CRTH2 RECEPTOR Argenta Discovery Limited (GB) 2008-06-18 EP disclosed
WO-2007031747-A1 IMDOLIZINE DERIVATIVES AS LIGANDS OF THE CRTH2 RECEPTOR ARGENTA DISCOVERY LIMITED (GB) 2007-03-22 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 (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-20080306109-A1 Indolizine Derivatives as Ligands of the Crth2 Receptor HRH4, HRH2, HRH3 AKR1B1 1414/4885PTGDR2 293/4885SMN1; SMN2 4618/4885

“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.