SCHEMBL4033468

SCHEMBL4033468

Cc1oc(-c2ccccc2)nc1CCc1noc(COc2ccccc2CC(=O)O)n1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
PPARG P37231 16/20 0.48
PPARA Q07869 16/20 0.48
FFAR1 O14842 1/20 0.46
NPC1 O15118 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PPARD Q03181 3/20 0.43
HPGD P15428 1/20 0.42

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
SCHEMBL4038315 0.92 KDM4E (0.44) KDM4EPPARGPPARAFFAR1NPC1
SCHEMBL4038084 0.84 FFAR1 (0.58) KDM4EPPARGPPARAFFAR1PPARD
SCHEMBL4035468 0.83 KDR (0.57) KDM4EPPARGPPARAFFAR1
SCHEMBL5201483 0.82 KDM4E (0.63) KDM4EPPARGPPARAFFAR1MAPT
SCHEMBL4033261 0.81 KDM4E (0.52) KDM4EPPARGPPARAFFAR1PPARD
SCHEMBL4029543 0.79 PPARG (0.67) PPARGPPARAFFAR1PPARD
SCHEMBL4028344 0.79 KDM4E (0.51) KDM4EPPARGPPARAFFAR1PPARD
SCHEMBL6998371 0.79 KDM4E (0.53) KDM4EPPARGPPARAFFAR1MAPT
SCHEMBL4034810 0.77 KDR (0.55) PPARGPPARAFFAR1
SCHEMBL4035236 0.77 PPARG (0.64) PPARGPPARA

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.