SCHEMBL3482931

SCHEMBL3482931

CCc1cccc(N2C(=O)C=CC2=O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 13/20 1.00
FAAH O00519 4/20 0.64
HSP90AA1 P07900 3/20 0.59
ALDH1A1 P00352 2/20 0.58
PKM P14618 2/20 0.58
HTT P42858 2/20 0.58
ATM Q13315 1/20 0.58
PARP1 P09874 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
XBP1 P17861 1/20 0.49
MAPK1 P28482 1/20 0.49
CCR6 P51684 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HPN P05981 1/20 0.49
ALOX5 P09917 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
SCHEMBL18661434 0.86 MGLL (0.75) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL31664393 0.85 MGLL (0.73) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL1683222 0.85 MGLL (0.73) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL19508523 0.81 MGLL (0.69) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL18469620 0.81 MGLL (0.69) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL17208730 0.81 MGLL (0.69) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL18814236 0.81 MGLL (0.68) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL19512034 0.80 MGLL (0.67) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL7101837 0.80 MGLL (0.67) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL24452700 0.80 MGLL (0.66) MGLLFAAHHSP90AA1ALDH1A1PKM

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110724154-A Polysubstituted pyrrolo [3,4-d ] isoxazole derivative and synthetic method thereof 湖北科技学院 2020-01-24 CN claimed
CN-110724154-B Polysubstituted pyrrolo [3,4-d ] isoxazole derivative and synthetic method thereof 湖北科技学院 2020-08-04 CN disclosed
CN-110724154-A Polysubstituted pyrrolo [3,4-d ] isoxazole derivative and synthetic method thereof 湖北科技学院 2020-01-24 CN disclosed
US-20190125882-A1 ISATOIC ANHYDRIDE DERIVATIVES AND APPLICATIONS THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE (US) 2019-05-02 US disclosed
US-10256449-B2 Porous membrane separator for secondary battery, method for producing the same, and secondary battery ZEON CORPORATION (JP) 2019-04-09 US disclosed
CN-105384865-B Optical resin material, the manufacturing method of the optical resin material, the optical resin component containing the material and the polarizing film containing the component 小池康博 2019-02-19 CN disclosed
US-10179175-B2 Isatoic anhydride derivatives and applications thereof THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE (US) 2019-01-15 US disclosed
US-20180110862-A1 ISATOIC ANHYDRIDE DERIVATIVES AND APPLICATIONS THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE 2018-04-26 US disclosed
US-20180110862-A1 ISATOIC ANHYDRIDE DERIVATIVES AND APPLICATIONS THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE 2018-04-26 US disclosed
US-9867883-B2 Isatoic anhydride derivatives and applications thereof THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE (US) 2018-01-16 US disclosed
US-7705105-B2 A cyclic polymer of silsesquioxane skeleton with side chains formed byhydrosilation of an unsaturated end group containing an active polymerfunctional group; polyimidesiloxane copolymers; polyestersiloxane copolymers; high molecular weight; thin films; strength; heat resistance;waterproofing; CHISSO PETROCHEMICAL CORPORATION (JP) 2010-04-27 US disclosed
CN-100504541-C Liquid crystal display device and polarizing disc combination therefor SUMITOMO CHEMICAL CO (JP) 2009-06-24 CN disclosed
US-20070190344-A1 Verification of translation JNC CORPORATION (JP) 2007-08-16 US disclosed
CN-1811555-A Liquid crystal display device and polarizing disc combination therefor SUMIKA PLASTECH CO LTD (JP) 2006-08-02 CN disclosed
US-7018697-B2 Optical recording medium TDK CORPORATION (JP) 2006-03-28 US disclosed
US-20050009982-A1 Compound having silsesquioxane skeleton and its polymer CHISSO CORPORATION (JP) 2005-01-13 US disclosed
US-20040241378-A1 A substrate; and a light transmitting layer having a thickness smaller than that of the substrate where the substrate is a copolymer of an N-phenyl maleimide, an N-alkylmaleimide, and an olefin such as isobutene; nonwarping TDK CORPORATION (JP) 2004-12-02 US disclosed
EP-0348906-B1 HEAT-RESISTANT RESIN COMPOSITION SHOWA DENKO KABUSHIKI KAISHA (JP) 1992-10-07 EP disclosed
US-4994515-A Resin of styrene and unsaturated imide, high impact thermoplastic, bromine-containing reaction product, silicon resin or compound SHOWA DENKO KABUSHIKI KAISHA (JP) 1991-02-19 US disclosed
EP-0348906-A1 Heat-resistant resin composition SHOWA DENKO KABUSHIKI KAISHA (JP) 1990-01-03 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 (4 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-10179175-B2 Isatoic anhydride derivatives and applications thereof AASDHPPT, CA13, CA12 MGLL 4080/4885FAAH 380/4885HSP90AA1 2859/4885
US-20190125882-A1 ISATOIC ANHYDRIDE DERIVATIVES AND APPLICATIONS THEREOF AASDHPPT, CA13, CA12 MGLL 4080/4885FAAH 380/4885HSP90AA1 2859/4885
US-20180110862-A1 ISATOIC ANHYDRIDE DERIVATIVES AND APPLICATIONS THEREOF AASDHPPT, CA13, CA12 MGLL 4080/4885FAAH 380/4885HSP90AA1 2859/4885
US-20050009982-A1 Compound having silsesquioxane skeleton and its polymer C1S, H1-4, H1-0 MGLL 4700/4885FAAH 4471/4885HSP90AA1 4031/4885

“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.