SCHEMBL87589

SCHEMBL87589

O=C(O)c1ccc2c(c1C(=O)O)Sc1ccccc1S2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
ALOX15 P16050 2/20 0.40
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
AKR1C3 P42330 1/20 0.37
CDC25B P30305 3/20 0.37
CDC25A P30304 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALOX5 P09917 1/20 0.36
CYP1A2 P05177 1/20 0.35
LMNA P02545 2/20 0.35
THRB P10828 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
HMGB1 P09429 1/20 0.35
HPGD P15428 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35

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
SCHEMBL7016790 0.86 HSD17B10 (0.37) ALDH1A1ALOX15MAPTGAACDC25B
Thianthrene SCHEMBL30108387 0.79 ALDH1A1 (0.50) ALDH1A1ALOX15MAPTGAAAKR1C3
SCHEMBL30944663 0.79 ALDH1A1 (0.50) ALDH1A1ALOX15MAPTGAAAKR1C3
SCHEMBL2762894 0.79 ALDH1A1 (0.50) ALDH1A1ALOX15MAPTGAAAKR1C3
SCHEMBL8504210 0.77 NOX1 (0.40) ALOX15MAPTGAAALOX5LMNA
SCHEMBL9522264 0.77 CA12 (0.39) ALDH1A1ALOX15MAPTAKR1C3CDC25B
SCHEMBL87644 0.76 CYP2C9 (0.40) ALDH1A1ALOX15MAPTGAAAKR1C3
SCHEMBL11861960 0.72 ALDH1A1 (0.41) ALDH1A1ALOX15MAPTGAAAKR1C3
SCHEMBL8576654 0.72 PTPN1 (0.44) ALDH1A1ALOX15MAPTGAACDC25B
SCHEMBL28751707 0.71 ALOX5 (0.44) ALDH1A1ALOX15MAPTGAACDC25B

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 10 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
US-4079052-A Diazopigments containing pyridine derivatives CIBA-GEIGY CORPORATION (US) 1978-03-14 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 ALDH1A1 1882/4885ALOX15 1966/4885MAPT 1923/4885

“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.