SCHEMBL31318

SCHEMBL31318

O=C1NC(=O)c2cnccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 0.50
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
CDC25B P30305 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.43
CASP7 P55210 2/20 0.43
TP53 P04637 2/20 0.43
CYP3A4 P08684 2/20 0.43
MAPT P10636 2/20 0.43
CASP1 P29466 2/20 0.43
BLM P54132 2/20 0.43
CASP3 P42574 1/20 0.43
CASP2 P42575 1/20 0.43
CASP6 P55212 1/20 0.43
CASP8 Q14790 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
KDM4E B2RXH2 2/20 0.42
CDK2 P24941 4/20 0.41
CDC7 O00311 3/20 0.41

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
Trifluoroacetic Acid SCHEMBL6434973 0.84 NPSR1 (0.39) GSK3BMAOAMAOBCDC25BSMN1; SMN2
SCHEMBL22766048 0.74 HASPIN (0.44) GSK3BMAOAMAOBPPOXPDE3B
SCHEMBL30616365 0.72 MAOA (0.86) MAOAMAOBCDC25BSMN1; SMN2CASP7
SCHEMBL8417659 0.72 MAOA (0.86) MAOAMAOBCDC25BSMN1; SMN2CASP7
SCHEMBL16685145 0.72 MAOA (0.70) MAOAMAOBCDC25BSMN1; SMN2CASP7
SCHEMBL30956639 0.72 MAOA (0.70) MAOAMAOBCDC25BSMN1; SMN2CASP7
SCHEMBL9269089 0.72 MAOA (0.77) MAOAMAOBCDC25BSMN1; SMN2CASP7
SCHEMBL20618218 0.72 MAOA (0.77) MAOAMAOBCDC25BSMN1; SMN2CASP7
SCHEMBL31112247 0.72 MAOA (0.77) MAOAMAOBCDC25BSMN1; SMN2CASP7
SCHEMBL5390472 0.71 TDP2 (0.57) CASP7CASP3CASP6CASP8PDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250099442-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES INC 2025-03-27 US claimed
EP-4444721-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS Prothena Biosciences Limited (IE) 2024-10-16 EP claimed
US-20240109847-A1 HISTONE DEACETYLASE INHIBITORS THE UNIVERSITY OF QUEENSLAND (AU) 2024-04-04 US claimed
EP-4267539-A1 HISTONE DEACETYLASE INHIBITORS The University of Queensland (AU) 2023-11-01 EP claimed
WO-2023107722-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES LIMITED (IE) 2023-06-15 WO claimed
EP-3675839-B1 NOVEL COMPOUNDS HAVING ESTROGEN RECEPTOR ALPHA DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC (US) 2023-03-01 EP claimed
WO-2022133551-A1 HISTONE DEACETYLASE INHIBITORS THE UNIVERSITY OF QUEENSLAND (AU) 2022-06-30 WO claimed
CN-114249683-A Synthesis method of N-hydroxyimide compound 中国石化扬子石油化工有限公司 2022-03-29 CN claimed
CN-109515334-B Antibacterial waterproof shading curtain for vehicle and preparation process thereof 上海瀚氏科技集团有限公司 2020-05-05 CN claimed
WO-2013126156-A1 NITRIC OXIDE DONATING SELECTIVE GLUCOCORTICOID RECEPTOR AGONIST COMPOUNDS AND OPHTHALMIC COMPOSITIONS BAUSCH & LOMB INCORPORATED (US) 2013-08-29 WO claimed
EP-1042315-B1 CYCLIC IMIDE-SUBSTITUTED PYRIDYLALKANE, ALKENE, AND ALKINE CARBOXAMIDES USEFUL AS CYTOSTATIC AND IMMUNOSUPPRESSIVE AGENTS KLINGE CO CHEM PHARM FAB (DE) 2004-04-14 EP claimed
EP-1214325-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2002-06-19 EP claimed
WO-2001019831-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2001-03-22 WO claimed
EP-1042315-A1 CYCLIC IMIDE-SUBSTITUTED PYRIDYLALKANE, ALKENE, AND ALKINE CARBOXAMIDES USEFUL AS CYTOSTATIC AND IMMUNOSUPPRESSIVE AGENTS Klinge Pharma GmbH (DE) 2000-10-11 EP claimed
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US claimed
WO-1999031087-A1 CYCLIC IMIDE-SUBSTITUTED PYRIDYLALKANE, ALKENE AND ALKINE CARBOXAMIDES USEFUL AS CYTOSTATIC AND IMMUNOSUPPRESSIVE AGENTS KLINGE PHARMA GMBH (DE) 1999-06-24 WO claimed
WO-1998033786-A9 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS 1998-12-30 WO claimed
WO-1998033786-A1 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-08-06 WO claimed
EP-0724583-A1 PYRIDAZINO QUINOLINE COMPOUNDS ZENECA LIMITED (GB) 1996-08-07 EP claimed
WO-1995011244-A1 PYRIDAZINO QUINOLINE COMPOUNDS ZENECA LIMITED (GB) 1995-04-27 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20250099442-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS DYRK2, DYRK1A, DYRK1B GSK3B 80/4885MAOA 172/4885MAOB 257/4885
US-20240109847-A1 HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC3, HDAC11 GSK3B 926/4885MAOA 628/4885MAOB 564/4885

“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.