SCHEMBL87644

SCHEMBL87644

O=C(O)c1ccc2c(c1C(=O)O)Sc1ccccc1O2

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.40
ALOX5 P09917 3/20 0.37
ALDH1A1 P00352 2/20 0.34
ALOX15 P16050 1/20 0.34
KDM4E B2RXH2 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CDC25B P30305 2/20 0.33
CDC25A P30304 1/20 0.33
HSD17B10 Q99714 1/20 0.33
AKR1C3 P42330 1/20 0.33
NSD2 O96028 1/20 0.32
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL706923 0.85 CA12 (0.39) CYP2C9ALOX5ALDH1A1KDM4ENPSR1
SCHEMBL27924285 0.76 ALOX5 (0.38) CYP2C9ALOX5ALDH1A1KDM4ENPSR1
SCHEMBL87589 0.76 ALDH1A1 (0.40) CYP2C9ALOX5ALDH1A1ALOX15KDM4E
SCHEMBL6450659 0.73 TRPA1 (0.42) CYP2C9ALOX5ALDH1A1KDM4EHSD17B10
SCHEMBL87485 0.72 CYP2C9 (0.45) CYP2C9ALOX5ALDH1A1ALOX15KDM4E
SCHEMBL7790465 0.72 ALOX5 (0.36) CYP2C9ALOX5ALDH1A1KDM4ENPSR1
SCHEMBL706922 0.71 ALOX5 (0.38) CYP2C9ALOX5ALDH1A1KDM4ENPSR1
SCHEMBL6840199 0.70 ALOX5 (0.54) ALOX5ALDH1A1KDM4EMAPT
SCHEMBL1574135 0.70 ALOX5 (0.43) CYP2C9ALOX5ALDH1A1ALOX15KDM4E
SCHEMBL10422639 0.70 AKR1B1 (0.43) CYP2C9ALDH1A1NPSR1

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 9 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
EP-1347015-B1 Resin composition and molded product DAINIPPON INK & CHEMICALS (JP) 2005-09-21 EP disclosed
US-6677406-B2 Heat resistance; impact strength; dimensional stability; molding materials DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-01-13 US disclosed
US-20030187150-A1 Resin composition and molded product DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-10-02 US disclosed
EP-1347015-A1 Resin composition and molded product DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-09-24 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-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 CYP2C9 2591/4885ALOX5 899/4885ALDH1A1 1882/4885

“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.