SCHEMBL4097419

SCHEMBL4097419

COCOc1ccc(C(=O)c2ccc(O)cc2)c(OCc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.51
PTGES O14684 1/20 0.50
ATM Q13315 1/20 0.48
SRD5A2 P31213 2/20 0.48
POLB P06746 1/20 0.47
HPGD P15428 3/20 0.47
MAPK1 P28482 2/20 0.47
LMNA P02545 2/20 0.47
CYP1A2 P05177 2/20 0.47
SLC6A2 P23975 2/20 0.47
CYP2C19 P33261 2/20 0.47
SLC6A3 Q01959 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 2/20 0.47
PGR P06401 1/20 0.47
CYP2D6 P10635 1/20 0.47
PDE4A P27815 1/20 0.47
HRH1 P35367 1/20 0.47
PDE4D Q08499 1/20 0.47
MAPT P10636 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
SCHEMBL4103033 0.86 POLB (0.56) MAOBPTGESSRD5A2POLBHPGD
SCHEMBL1962771 0.84 MAOB (0.64) MAOBCYP2C19MAPTNPC1SMN1; SMN2
SCHEMBL5119495 0.83 SRD5A2 (0.59) MAOBPTGESATMSRD5A2POLB
SCHEMBL4091547 0.82 NPC1 (0.64) POLBHPGDMAPK1LMNACYP1A2
SCHEMBL28249518 0.82 POLB (0.67) ATMPOLBHPGDMAPK1LMNA
SCHEMBL3998488 0.81 SRD5A2 (0.58) MAOBPTGESATMSRD5A2POLB
SCHEMBL14587603 0.81 MEN1 (0.57) MAOBPTGESATMSRD5A2HPGD
SCHEMBL1961888 0.81 MAOB (0.53) MAOBHPGDCYP2C19ALDH1A1MAPT
SCHEMBL4102751 0.79 MAOB (0.49) MAOBSRD5A2POLBHTTNPC1
SCHEMBL4107823 0.79 FFAR1 (0.55) POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090054435-A1 Phenoxyalkanoic Acid Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-26 US disclosed
EP-1911738-A1 PHENOXYALKANOIC ACID COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 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-20090054435-A1 Phenoxyalkanoic Acid Compound PNLIP, GPR119, LIPC MAOB 3361/4885PTGES 773/4885ATM 3130/4885

“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.