SCHEMBL5855290

SCHEMBL5855290

CC(=O)SCC(CCCCc1nc(-c2ccc(C)cc2)oc1C)CSC(C)=O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.53
PPARA Q07869 11/20 0.53
SMN1; SMN2 Q16637 4/20 0.46
ALDH1A1 P00352 2/20 0.46
POLB P06746 2/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44
KDM4E B2RXH2 1/20 0.44
PPARD Q03181 1/20 0.43
PKM P14618 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL5855349 0.84 PPARA (0.56) PPARGPPARASMN1; SMN2ALDH1A1POLB
SCHEMBL5856042 0.82 PPARG (0.51) PPARGPPARASMN1; SMN2ALDH1A1POLB
SCHEMBL5858335 0.81 PPARG (0.58) PPARGPPARASMN1; SMN2ALDH1A1POLB
SCHEMBL5855653 0.80 PPARG (0.48) PPARGPPARASMN1; SMN2ALDH1A1POLB
SCHEMBL5857060 0.80 PPARG (0.48) PPARGPPARASMN1; SMN2ALDH1A1POLB
SCHEMBL5855420 0.75 PPARG (0.56) PPARGPPARASMN1; SMN2ALDH1A1POLB
SCHEMBL5856859 0.74 PPARG (0.55) PPARGPPARASMN1; SMN2ALDH1A1POLB
SCHEMBL5855804 0.73 PPARG (0.53) PPARGPPARASMN1; SMN2ALDH1A1POLB
SCHEMBL5857590 0.72 PPARG (0.55) PPARGPPARAKDM4EPPARD
SCHEMBL5857297 0.72 PPARG (0.61) PPARGPPARAKDM4EPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7144906-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-12-05 US disclosed
US-7030143-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-18 US disclosed
US-7022723-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-04 US disclosed
EP-1634876-A2 Heterocyclic compounds for the treatment of hyperlipidemia agents Nippon Shinyaku Co., Ltd. (JP) 2006-03-15 EP disclosed
US-6998412-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-02-14 US disclosed
US-20050009892-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2005-01-13 US disclosed
US-20050009785-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2005-01-13 US disclosed
US-20040162325-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2004-08-19 US disclosed
US-20030166697-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2003-09-04 US disclosed
EP-1295875-A1 HETEROCYCLIC COMPOUNDS Nippon Shinyaku Co., Ltd. (JP) 2003-03-26 EP 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 (4 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-20050009785-A1 Heterocyclic compounds LIPC, GPR119, APOB PPARG 393/4885PPARA 464/4885SMN1; SMN2 4207/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE PPARG 603/4885PPARA 579/4885SMN1; SMN2 4287/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC PPARG 701/4885PPARA 660/4885SMN1; SMN2 4370/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC PPARG 701/4885PPARA 660/4885SMN1; SMN2 4370/4885

“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.