SCHEMBL5655165

SCHEMBL5655165

COC(=O)CSCc1cccc(O[C@@H](C)c2coc(-c3ccccc3)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SENP1 Q9P0U3 1/20 0.45
CYP1A2 P05177 1/20 0.45
PPARA Q07869 8/20 0.43
ELANE P08246 1/20 0.40
PPARG P37231 5/20 0.39
DGAT2 Q96PD7 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 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
SCHEMBL4398735 0.80 PPARA (0.53) SENP1CYP1A2PPARAPPARG
SCHEMBL4391303 0.77 MAPT (0.50) SENP1PPARAPPARGMAPTKDM4E
SCHEMBL4396651 0.75 KDR (0.47) SENP1CYP1A2PPARAPPARGMAPT
SCHEMBL7227753 0.74 ADCY1 (0.47) PPARAPPARGMAPTKDM4ENPSR1
SCHEMBL5229275 0.73 PPARA (0.48) PPARAPPARG
SCHEMBL4393332 0.73 KDR (0.68) PPARAPPARGMAPTSMN1; SMN2
SCHEMBL4391194 0.72 PPARG (0.64) PPARAPPARG
SCHEMBL7154961 0.72 PPARG (0.49) PPARAPPARGKDM4EALDH1A1
SCHEMBL5651632 0.72 PPARG (0.49) PPARAPPARG
SCHEMBL4391339 0.71 PPARG (0.60) PPARAPPARG

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-7211591-B2 Carboxylic acid derivative and a pharmaceutical composition containing the derivative as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2007-05-01 US disclosed
US-20050250824-A1 Carboxylic acid derivative and a pharmaceutical composition containing the derivative as active ingredient ONO PHARMACEUTICAL CO., LTD. 2005-11-10 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-20050250824-A1 Carboxylic acid derivative and a pharmaceutical composition containing the derivative as active ingredient PPARA, PPARG, PPARD SENP1 2505/4885CYP1A2 322/4885PPARA 1/4885

“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.