SCHEMBL7670922

SCHEMBL7670922

[O]Cc1ccc(CO)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
CA2 P00918 3/20 0.48
CA1 P00915 2/20 0.48
CA12 O43570 2/20 0.48
CA4 P22748 2/20 0.48
CA6 P23280 2/20 0.48
CA5A P35218 2/20 0.48
CA7 P43166 2/20 0.48
CA9 Q16790 2/20 0.48
CA14 Q9ULX7 2/20 0.48
CA5B Q9Y2D0 2/20 0.48
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
VHL P40337 1/20 0.42
ELOC Q15369 1/20 0.42
ELOB Q15370 1/20 0.42
LTA4H P09960 1/20 0.42
TYR P14679 1/20 0.41
NOS3 P29474 1/20 0.39

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
SCHEMBL5358862 0.83 ALDH1A1 (0.37) TSHRCA2CA9HPGDTDP1
SCHEMBL41775 0.83 TSHR (0.67) TSHRCA2CA1CA12CA4
Formaldehyde SCHEMBL8673672 0.80 TSHR (0.56) TSHRCA2CA1CA12CA4
SCHEMBL29413339 0.79 TSHR (0.62) TSHRCA2CA1CA12CA4
SCHEMBL1366942 0.79 ALDH1A1 (0.52) TSHRCA2CA1CA12CA4
SCHEMBL7546992 0.77 ALDH1A1 (0.50) TSHRCA2CA1CA12CA4
SCHEMBL31672218 0.76 TSHR (0.59) TSHRCA2CA1CA12CA4
SCHEMBL12810991 0.75 TSHR (0.50) TSHRCA2CA1CA12CA4
SCHEMBL136892 0.75
Formic Acid SCHEMBL11392898 0.75 TSHR (0.50) TSHRCA2CA1CA12CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0493529-B1 YTTRIUM AND RARE EARTH COMPOUNDS CATALYZED LACTONE POLYMERIZATION DU PONT (US) 1995-07-05 EP claimed
EP-0493529-A1 YTTRIUM AND RARE EARTH COMPOUNDS CATALYZED LACTONE POLYMERIZATION. DU PONT (US) 1992-07-08 EP claimed
US-5028667-A Biodegradable Polymers For Medical Uses And Flexible Films For Packaging E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-07-02 US claimed
WO-1991005001-A1 YTTRIUM AND RARE EARTH COMPOUNDS CATALYZED LACTONE POLYMERIZATION E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-04-18 WO claimed
CN-110256450-A Phenyl ring substituted phthalocyanine/graphene oxide composite non-linear optical material and preparation method thereof 黑龙江大学 2019-09-20 CN disclosed
US-6476021-B1 Compounds having cGMP-PDE inhibitory effect MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-11-05 US disclosed
EP-1048666-A1 NOVEL COMPOUNDS HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 EP disclosed
US-5932675-A Free-radical chain transfer polymerization process COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1999-08-03 US disclosed
US-5874511-A CHAIN TRANSFER E. I. DU PONT DE NEMOURS AND COMPANY (US) 1999-02-23 US disclosed
EP-0493529-B1 YTTRIUM AND RARE EARTH COMPOUNDS CATALYZED LACTONE POLYMERIZATION DU PONT (US) 1995-07-05 EP disclosed
US-5374743-A using larger amounts of catalyst for depolymerization, then dimerization of lactic or glycolic acid oligomers having controlled molecular weights E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-12-20 US disclosed
EP-0493529-A1 YTTRIUM AND RARE EARTH COMPOUNDS CATALYZED LACTONE POLYMERIZATION. DU PONT (US) 1992-07-08 EP disclosed
US-5095098-A Biodegradable E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-03-10 US disclosed
US-5028667-A Biodegradable Polymers For Medical Uses And Flexible Films For Packaging E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-07-02 US disclosed
WO-1991005001-A1 YTTRIUM AND RARE EARTH COMPOUNDS CATALYZED LACTONE POLYMERIZATION E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-04-18 WO disclosed