SCHEMBL69789

SCHEMBL69789

O=C(O)CCCc1ccc(CCc2ccc(CCCC(=O)O)cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.78
HDAC3 O15379 2/20 0.78
HDAC4 P56524 2/20 0.78
HDAC1 Q13547 2/20 0.78
HDAC7 Q8WUI4 2/20 0.78
HDAC2 Q92769 2/20 0.78
HDAC10 Q969S8 2/20 0.78
HDAC11 Q96DB2 2/20 0.78
HDAC8 Q9BY41 2/20 0.78
HDAC6 Q9UBN7 2/20 0.78
HDAC9 Q9UKV0 2/20 0.78
HDAC5 Q9UQL6 2/20 0.78
MAPK1 P28482 1/20 0.78
ADRA1A P35348 1/20 0.78
SLC6A3 Q01959 1/20 0.78
HSD17B10 Q99714 2/20 0.70
FFAR1 O14842 4/20 0.66
MAPT P10636 2/20 0.65
RXFP1 Q9HBX9 1/20 0.65
RXRA P19793 1/20 0.61

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
SCHEMBL6208836 0.97 SMN1; SMN2 (0.82) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL7827144 0.91 MAPT (0.80) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL7065645 0.90 MAPT (0.79) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL25172929 0.89 HSD17B10 (0.65) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL11477107 0.89 SMN1; SMN2 (0.69) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL27619975 0.89 SMN1; SMN2 (0.69) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL29129893 0.89 SMN1; SMN2 (0.69) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL284671 0.89 SMN1; SMN2 (0.69) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
Phenylbutanoic Acid SCHEMBL1716 0.88 HDAC1 (1.00) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
Phenylbutanoic Acid SCHEMBL1021513 0.88 HDAC1 (1.00) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479203-A1 AROMATIC POLYESTER Muroran Institute of Technology (JP) 2012-07-25 EP disclosed
US-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed
US-8129493-B2 Aromatic polyester MURORAN INSTITUTE OF TECHNOLOGY (JP) 2012-03-06 US disclosed
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME MURORAN INSTITUTE OF TECHNOLOGY (JP) 2011-09-15 US disclosed
US-20110092662-A1 AROMATIC POLYESTER NITTA CORPORATION (JP) 2011-04-21 US 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-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 SMN1; SMN2 4357/4885HDAC3 810/4885HDAC4 211/4885

“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.