SCHEMBL8233124

SCHEMBL8233124

COC(=O)[C@@](C)(CSCc1ccccc1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.45
PPARA Q07869 3/20 0.45
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
CYP2C19 P33261 1/20 0.42
CTRB1 P17538 1/20 0.42
KCNN4 O15554 1/20 0.41
PPARD Q03181 2/20 0.41
MMP8 P22894 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
ACE P12821 1/20 0.39
IDO1 P14902 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL8233122 0.94 CYP2C19 (0.45) PPARGPPARAGAAHTTCYP2C19
SCHEMBL8233844 0.85 MMP8 (0.55) PPARGPPARACYP2C19MMP8RAB9A
SCHEMBL13696274 0.83 CYP2C19 (0.46) PPARGPPARACYP2C19PPARDRAB9A
SCHEMBL8231003 0.82 HTT (0.43) PPARGPPARAGAAHTTCYP2C19
SCHEMBL8233123 0.81 CYP2C19 (0.45) PPARGPPARACYP2C19SMN1; SMN2ALDH1A1
SCHEMBL4098653 0.81 PPARG (0.40) PPARGPPARAHTTCYP2C19PPARD
SCHEMBL15161546 0.79 GAA (0.41) PPARGPPARAGAAHTTCYP2C19
SCHEMBL13696272 0.79 CYP2C19 (0.49) PPARGPPARAGAAHTTCYP2C19
SCHEMBL9691089 0.79 MMP8 (0.56) PPARGPPARACYP2C19CTRB1KCNN4
SCHEMBL4098649 0.79 MMP8 (0.57) PPARGPPARACYP2C19MMP8RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090221640-A1 Novel Crystal Modifications ASTRAZENECA AB (SE) 2009-09-03 US disclosed
WO-2007106022-A2 A NEW CRYSTALLINE FORM G OF (5S) -5- [4- (5-CHLORO-PYRIDIN-2- YLOXY) -PIPERIDINE-1-SULFONYLMETHYL] - 5 -METHYL -IMIDAZOLIDINE - 2,4-DIONE (I) AND INTERMEDIATES THEREOF. ASTRAZENECA AB (SE) 2007-09-20 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 (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-20090221640-A1 Novel Crystal Modifications PTMS, NT5C, CDK5 PPARG 1184/4885PPARA 1009/4885GAA 1891/4885

“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.