SCHEMBL4031089

SCHEMBL4031089

Cc1oc(-c2ccccc2)nc1CCC(N)=O

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.65
PPARG P37231 15/20 0.58
PPARA Q07869 13/20 0.58
HPGD P15428 1/20 0.56
FFAR1 O14842 1/20 0.55
PPARD Q03181 1/20 0.55
HRH3 Q9Y5N1 1/20 0.54
NR4A2 P43354 1/20 0.50

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
SCHEMBL4034559 0.88 KDM4E (0.73) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL4035726 0.86 KDM4E (0.57) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL4936759 0.85 KDM4E (0.78) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL7903354 0.85 PPARG (0.71) PPARGPPARAFFAR1PPARD
SCHEMBL5856050 0.83 KDM4E (0.62) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL13721668 0.82 KDM4E (0.60) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL14373654 0.81 KDM4E (0.59) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL12008131 0.81 KDM4E (0.62) KDM4EHPGD
SCHEMBL979145 0.80 KDM4E (0.65) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL1436970 0.80 HRH3 (0.61) KDM4EPPARGPPARAHPGDFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1357115-B1 ALKANOIC ACID DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2009-06-17 EP disclosed
US-7238716-B2 Alkanoic acid derivatives process for their production and use thereof TAKEDA PHARMACEUTICALS COMPANY LIMITED (JP) 2007-07-03 US disclosed
US-20040058965-A1 Alkanoic acid derivatives process for their production and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-25 US disclosed
EP-1357115-A1 ALKANOIC ACID DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-10-29 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 (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-20040058965-A1 Alkanoic acid derivatives process for their production and use thereof GPR119, ACOX1, ALK KDM4E 570/4885PPARG 593/4885PPARA 156/4885

“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.