SCHEMBL5855827

SCHEMBL5855827

Cc1oc(-c2ccccc2)nc1Cc1ccc(C(CO)CO)cc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.53
PPARA Q07869 13/20 0.53
KDM4E B2RXH2 1/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
KDR P35968 1/20 0.50
HPGD P15428 1/20 0.46
FFAR1 O14842 1/20 0.46

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
SCHEMBL5855692 0.86 KDR (0.56) PPARGPPARAKDM4ENPC1RAB9A
SCHEMBL5858038 0.85 PPARG (0.53) PPARGPPARAKDM4ENPC1RAB9A
SCHEMBL5855712 0.77 PPARG (0.55) PPARGPPARAKDM4ENPC1RAB9A
SCHEMBL4037331 0.76 KDM4E (0.69) PPARGPPARAKDM4ENPC1RAB9A
SCHEMBL1874497 0.75 KDM4E (0.60) PPARGPPARAKDM4ENPC1RAB9A
SCHEMBL979145 0.73 KDM4E (0.65) PPARGPPARAKDM4ENPC1RAB9A
SCHEMBL4031706 0.73 KDR (0.57) PPARGPPARAKDM4EKDRHPGD
SCHEMBL31180903 0.72 PPARG (0.52) PPARGPPARAKDM4EKDRFFAR1
SCHEMBL8799936 0.72 KDM4E (0.46) PPARGPPARAKDM4ENPC1RAB9A
SCHEMBL8551321 0.72 KDM4E (0.46) PPARGPPARAKDM4ENPC1RAB9A

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 464/4885KDM4E 1600/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE PPARG 603/4885PPARA 579/4885KDM4E 1141/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC PPARG 701/4885PPARA 660/4885KDM4E 1321/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC PPARG 701/4885PPARA 660/4885KDM4E 1321/4885

“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.