SCHEMBL4035310

SCHEMBL4035310

Cc1oc(-c2ccc3ccccc3c2)nc1COc1ccc(COc2ncccc2CO)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.50
FFAR1 O14842 1/20 0.48
PPARG P37231 8/20 0.45
PPARA Q07869 8/20 0.45
TP53 P04637 1/20 0.43
MAPT P10636 5/20 0.42
POLB P06746 2/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL4032658 0.91 FFAR1 (0.59) KDRFFAR1PPARGPPARATP53
SCHEMBL4031957 0.89 FFAR1 (0.55) KDRFFAR1PPARGPPARATP53
SCHEMBL4030120 0.88 FFAR1 (0.44) KDRFFAR1PPARGPPARATP53
SCHEMBL4029049 0.85 KDR (0.64) KDRFFAR1PPARGPPARATP53
SCHEMBL4037200 0.84 FFAR1 (0.46) KDRFFAR1PPARGPPARAMAPT
SCHEMBL4031686 0.83 FFAR1 (0.60) KDRFFAR1PPARGPPARATP53
SCHEMBL4031542 0.82 FFAR1 (0.43) KDRFFAR1PPARGPPARATP53
SCHEMBL4028802 0.80 FFAR1 (0.64) KDRFFAR1PPARGPPARATP53
SCHEMBL4035460 0.80 FFAR1 (0.63) KDRFFAR1PPARGPPARATP53
SCHEMBL6583109 0.79 FFAR1 (0.57) KDRFFAR1PPARGPPARATP53

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 1328/4885FFAR1 4/4885PPARG 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.