SCHEMBL4031684

SCHEMBL4031684

COC(=O)Cc1ccccc1OCc1cccc(OCc2nc(-c3ccccc3)oc2C)c1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.63
MAPT P10636 4/20 0.54
PPARG P37231 12/20 0.53
PPARA Q07869 12/20 0.53
FFAR1 O14842 1/20 0.52
CYP2C9 P11712 3/20 0.50
KCNH2 Q12809 3/20 0.50
TP53 P04637 1/20 0.49

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
SCHEMBL4031041 0.92 KDR (0.67) KDRMAPTPPARGPPARAFFAR1
SCHEMBL4032005 0.90 KDR (0.52) KDRMAPTPPARGPPARAFFAR1
SCHEMBL3526019 0.89 KDR (0.73) KDRMAPTPPARGPPARAFFAR1
SCHEMBL4034984 0.88 KDM4E (0.53) KDRMAPTPPARGPPARAFFAR1
SCHEMBL4029143 0.87 KDR (0.60) KDRMAPTPPARGPPARAFFAR1
SCHEMBL4038098 0.86 KDR (0.67) KDRMAPTPPARGPPARAFFAR1
SCHEMBL4036830 0.84 KDR (0.61) KDRMAPTPPARGPPARAFFAR1
SCHEMBL4034707 0.84 KDR (0.63) KDRMAPTPPARGPPARAFFAR1
SCHEMBL4032797 0.84 PPARG (0.52) PPARGPPARAFFAR1
SCHEMBL4031039 0.84 KDR (0.74) KDRPPARGPPARAFFAR1CYP2C9

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 KDR 1328/4885MAPT 4719/4885PPARG 593/4885

“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.