SCHEMBL4099649

SCHEMBL4099649

COCOc1cc(OC)cc(C)c1C(=O)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.51
MAOB P27338 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
ALDH1A1 P00352 2/20 0.48
HTT P42858 2/20 0.48
RAB9A P51151 4/20 0.48
NPC1 O15118 2/20 0.48
POLB P06746 1/20 0.48
NR4A1 P22736 1/20 0.48
NR4A2 P43354 1/20 0.48
NR4A3 Q92570 1/20 0.48
TP53 P04637 1/20 0.47
PKM P14618 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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 0.85 POLB (0.56) SRD5A2MAOBL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL4093376 0.85 CYP3A4 (0.45) SMN1; SMN2ALDH1A1HTTNPC1POLB
SCHEMBL4102751 0.83 MAOB (0.49) SRD5A2MAOBL3MBTL1SMN1; SMN2HTT
SCHEMBL4092308 0.82 HTT (0.56) SRD5A2MAOBL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL4102816 0.81 MAPT (0.58) POLBTP53MAPTFFAR1PPARG
SCHEMBL1390921 0.80 HPGD (0.46) MAOBL3MBTL1ALDH1A1RAB9ANPC1
SCHEMBL3998488 0.79 SRD5A2 (0.58) SRD5A2MAOBL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL26047475 0.78 HDAC8 (0.49) MAOBL3MBTL1SMN1; SMN2RAB9ANPC1
SCHEMBL12553520 0.78 CYP3A4 (0.47) MAOBSMN1; SMN2ALDH1A1HTTRAB9A
SCHEMBL4102407 0.76 KMT2A (0.49) SMN1; SMN2ALDH1A1HTTPOLBTP53

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 SRD5A2 1533/4885MAOB 3361/4885L3MBTL1 1870/4885

“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.