SCHEMBL2372316

SCHEMBL2372316

O=C1Nc2ccc(C(F)(F)F)cc2C1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 4/20 0.58
TGM2 P21980 5/20 0.55
MAOA P21397 5/20 0.50
MAOB P27338 5/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CAPN9 O14815 1/20 0.49
CASP3 P42574 1/20 0.49
SLC6A11 P48066 1/20 0.47
PDE3B Q13370 1/20 0.47
PDE3A Q14432 1/20 0.47
PARP1 P09874 1/20 0.46
PARP10 Q53GL7 1/20 0.46
TDP2 O95551 1/20 0.46
JUN P05412 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46

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
SCHEMBL30120589 1.00 CES1 (0.58) CES1TGM2MAOAMAOBCA12
Hydrochloric Acid SCHEMBL11435666 0.98 CES1 (0.57) CES1TGM2MAOAMAOBCA12
Toluene SCHEMBL28093752 0.88 MAOA (0.51) CES1TGM2MAOAMAOBALDH1A1
SCHEMBL4679100 0.85 CES1 (0.55) CES1TGM2MAOAMAOBPARP1
SCHEMBL28878753 0.85 CES1 (0.55) CES1TGM2MAOAMAOBPARP1
SCHEMBL4445322 0.83 CES1 (0.53) CES1TGM2MAOAMAOBCA12
SCHEMBL1247409 0.81 TGM2 (0.55) CES1TGM2MAOAMAOBCA12
SCHEMBL30541907 0.81 TGM2 (0.55) CES1TGM2MAOAMAOBCA12
SCHEMBL13401353 0.81 TGM2 (0.55) CES1TGM2MAOAMAOBCA12
SCHEMBL8202497 0.81 ACVR1 (0.58) MAOAMAOBPARP1PARP10TDP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114950159-B Preparation method of aromatic polymer separation membrane based on super acid catalysis 南京工业大学 2023-06-06 CN claimed
CN-114950159-A Preparation method of aromatic polymer separation membrane based on super-acid catalysis preparation 南京工业大学 2022-08-30 CN claimed
CN-102875445-A Synthetic method of 5-trifluoromethyl isatin SHANDONG LUNUO ANIMAL PHARMACEUTICAL CO LTD 2013-01-16 CN claimed
US-20080255192-A1 2-(1-(4-chlorophenyl)cyclopropyl)-3-hydroxy-8-(trifluoromethoxy)quinoline-4-carboxylic acid; antiinflammtory agents; antagonists of the mammalian adhesion proteins WYETH (US) 2008-10-16 US claimed
US-20250171452-A1 TRYPTANTHRIN DERIVATIVES AND USES THEREOF VISCIENT BIO, INC. 2025-05-29 US disclosed
WO-2025045835-A1 PESTICIDALLY ACTIVE OXOINDOLE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2025-03-06 WO disclosed
EP-4514804-A1 TRYPTANTHRIN DERIVATIVES AND USES THEREOF Viscient Bio, Inc. (US) 2025-03-05 EP disclosed
WO-2023211977-A1 TRYPTANTHRIN DERIVATIVES AND USES THEREOF VISCIENT BIO, INC. (US) 2023-11-02 WO disclosed
WO-2023211977-A1 TRYPTANTHRIN DERIVATIVES AND USES THEREOF VISCIENT BIO, INC. (US) 2023-11-02 WO disclosed
CN-116535619-A Preparation method and application of high molecular weight arylene isatin polymer and ionic solvent film 宁波中科氢易膜科技有限公司 2023-08-04 CN disclosed
US-20230227409-A1 QUINOLINONE DERIVATIVES AS METHIONINE ADENOSYLTRANSFERASE 2A INHIBITORS IDEAYA BIOSCIENCES, INC. 2023-07-20 US disclosed
CN-114950159-B Preparation method of aromatic polymer separation membrane based on super acid catalysis 南京工业大学 2023-06-06 CN disclosed
US-4346034-A Process for preparing imidazodiazepines HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346032-A ANTIDOTES TO OVERDOSES OF BENZODIAZEPINE TRANQUILIZERS HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4316839-A Imidazodiazepine derivatives HOFFMAN-LA ROCHE INC. (US) 1982-02-23 US disclosed
EP-0002624-B1 2-BENZAZEPINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BECKMAN CORPORATION (US) 1981-10-14 EP disclosed
EP-0027214-A1 Imidazodiazepine derivatives, process and intermediates for their preparation, medicaments containing them and their therapeutic application F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1981-04-22 EP disclosed
US-4188325-A Isatin process and products REGENTS OF UNIVERSITY OF MINNESOTA (US) 1980-02-12 US disclosed
US-4186132-A Isatin products THE REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1980-01-29 US disclosed
EP-0002624-A1 2-Benzazepine compounds, processes for their preparation and pharmaceutical compositions containing them SMITHKLINE BECKMAN CORPORATION (US) 1979-06-27 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 (3 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-20230227409-A1 QUINOLINONE DERIVATIVES AS METHIONINE ADENOSYLTRANSFERASE 2A INHIBITORS MAT2B, MAT2A, MAT1A CES1 1028/4885TGM2 167/4885MAOA 367/4885
US-20250171452-A1 TRYPTANTHRIN DERIVATIVES AND USES THEREOF IDO2, IDO1, TPSB2 CES1 4319/4885TGM2 346/4885MAOA 37/4885
US-20080255192-A1 2-(1-(4-chlorophenyl)cyclopropyl)-3-hydroxy-8-(trifluoromethoxy)quinoline-4-carboxylic acid; antiinflammtory agents; antagonists of the mammalian adhesion proteins VCAM1, ICAM1, SELE CES1 1128/4885TGM2 1257/4885MAOA 1000/4885

“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.