SCHEMBL69321

SCHEMBL69321

O=C(O)c1ccccc1C#Cc1ccccc1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.62
ALOX15 P16050 1/20 0.62
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
CA12 O43570 3/20 0.52
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
CA4 P22748 3/20 0.52
CA7 P43166 3/20 0.52
CA9 Q16790 3/20 0.52
KDM4E B2RXH2 2/20 0.52
HMGB1 P09429 2/20 0.52
HPGD P15428 2/20 0.52
NAPRT Q6XQN6 2/20 0.52
CA6 P23280 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CA14 Q9ULX7 1/20 0.52
MAPT P10636 2/20 0.50
HDAC8 Q9BY41 1/20 0.50
POLB P06746 1/20 0.48

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
SCHEMBL29409566 1.00 ALDH1A1 (0.62) ALDH1A1ALOX15NPC1RAB9ACA12
SCHEMBL29479413 0.91 NPC1 (0.72) ALDH1A1ALOX15NPC1RAB9ACA12
SCHEMBL2256468 0.91 NPC1 (0.72) ALDH1A1ALOX15NPC1RAB9ACA12
SCHEMBL30607509 0.91 NPC1 (0.67) ALDH1A1ALOX15NPC1RAB9ACA12
SCHEMBL30011755 0.89 NPC1 (0.59) ALDH1A1ALOX15NPC1RAB9ACA12
SCHEMBL1535890 0.89 NPC1 (0.59) ALDH1A1ALOX15NPC1RAB9ACA12
SCHEMBL15546275 0.89 ALDH1A1 (0.54) ALDH1A1ALOX15NPC1RAB9ACA12
SCHEMBL576637 0.87 ALDH1A1 (0.52) ALDH1A1ALOX15NPC1RAB9ACA12
SCHEMBL69187 0.84 NPC1 (0.59) ALDH1A1ALOX15NPC1RAB9ANAPRT
SCHEMBL29789031 0.84 NPC1 (0.54) ALDH1A1ALOX15NPC1RAB9ACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105492535-B Composition for forming cured film, alignment material, and phase difference material 日产化学工业株式会社 2018-03-16 CN disclosed
CN-105492535-A Composition for forming cured film, alignment material, and phase difference material NISSAN CHEMICAL IND LTD 2016-04-13 CN disclosed
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-0980016-B1 ALIGNING AGENT FOR LIQUID CRYSTAL NISSAN CHEMICAL IND LTD (JP) 2008-09-24 EP disclosed
EP-1333050-B1 MATERIAL FOR INSULATING FILM, COATING VARNISH FOR INSULATING FILM, AND INSULATING FILM AND SEMICONDUCTOR DEVICE USING THE SAME SUMITOMO BAKELITE CO (JP) 2006-12-27 EP disclosed
US-7049371-B2 Material for an insulating film, coating varnish for an insulating film, and insulating film and semiconductor device using the same SUMITOMO BAKELITE COMPANY, LTD. (JP) 2006-05-23 US disclosed
US-20040002572-A1 Material for an insulating film, coating varnish for an insulating film, and insulating film and semiconductor device using the same SUMITOMO BAKELITE COMPANY, LTD. (JP) 2004-01-01 US disclosed
EP-1333050-A1 MATERIAL FOR INSULATING FILM, COATING VARNISH FOR INSULATING FILM, AND INSULATING FILM AND SEMICONDUCTOR DEVICE USING THE SAME SUMITOMO BAKELITE CO., LTD. (JP) 2003-08-06 EP disclosed
EP-1327653-A1 HEAT-RESISTANT RESIN PRECURSOR, HEAT-RESISTANT RESIN AND INSULATING FILM AND SEMICONDUCTOR DEVICE SUMITOMO BAKELITE CO., LTD. (JP) 2003-07-16 EP disclosed
US-6518390-B2 Polybenzoxazole and crosslinking agent SUMITOMO BAKELITE COMPANY, LTD. (JP) 2003-02-11 US disclosed
US-20020013443-A1 Precursor of a heat resistant resin, heat resistant resin, insulating film and semiconductor device SUMITOMO BAKELITE CO., LTD. (JP) 2002-01-31 US disclosed
EP-0980016-A1 ALIGNING AGENT FOR LIQUID CRYSTAL Nissan Chemical Industries, Ltd. (JP) 2000-02-16 EP disclosed
CN-1043349-C New sulfuric acid esters of sugar alcohols HOFFMANN LA ROCHE (CH) 1999-05-12 CN disclosed
CN-1109889-A New sulfuric acid esters of sugar alcohols HOFFMANN LA ROCHE (CH) 1995-10-11 CN 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 1966/4885NPC1 4583/4885

“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.