SCHEMBL223194

SCHEMBL223194

O=C1[C]=CC(=O)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 5/20 0.48
CDC25B P30305 4/20 0.48
MAOA P21397 4/20 0.48
MAOB P27338 3/20 0.48
SNCA P37840 2/20 0.48
AKT1 P31749 1/20 0.48
MAP2K1 Q02750 1/20 0.48
PIN1 Q13526 1/20 0.48
EHMT2 Q96KQ7 1/20 0.48
NSD1 Q96L73 1/20 0.48
EHMT1 Q9H9B1 1/20 0.48
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MAPT P10636 5/20 0.38
LMNA P02545 4/20 0.38
MAPK1 P28482 4/20 0.38
KDM4E B2RXH2 3/20 0.38
PLIN1 O60240 2/20 0.38
BLM P54132 2/20 0.38
PLIN5 Q00G26 2/20 0.38

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
SCHEMBL216271 0.75 MAOA (0.42) IDO1CDC25BMAOAMAOBSNCA
SCHEMBL670373 0.75 EHMT2 (0.40) IDO1CDC25BMAOAMAOBSNCA
SCHEMBL20483611 0.72 MEN1 (0.37) IDO1CDC25BMAOAMAOBSNCA
SCHEMBL7832139 0.70 S100A4 (0.55) CDC25BMEN1KMT2AMAPTBLM
SCHEMBL2095985 0.69 KMT2A (0.50) IDO1CDC25BMAOAMAOBSNCA
SCHEMBL415465 0.67 MEN1 (0.42) IDO1CDC25BMAOAMAOBSNCA
SCHEMBL725425 0.67 MEN1 (0.45) IDO1CDC25BMAOAMAOBSNCA
Naphthoquinone SCHEMBL29354680 0.66 IDO1 (1.00) IDO1CDC25BMAOAMAOBSNCA
Naphthoquinone SCHEMBL11359780 0.66 IDO1 (1.00) IDO1CDC25BMAOAMAOBSNCA
Naphthoquinone SCHEMBL8861335 0.66 IDO1 (1.00) IDO1CDC25BMAOAMAOBSNCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023249805-A1 CO2 PURIFICATION SYSTEM AND METHOD USING CO2-ABSORBING ELECTRODE CELLS COMBINED WITH PURE CO2 REDUCTION IN AN ELECTROLYZER TO PRODUCE CARBON CONTAINING PRODUCTS TWELVE BENEFIT CORPORATION (US) 2023-12-28 WO claimed
US-20230415104-A1 CO2 PURIFICATION WITH ELECTROACTIVE POLYMERS TWELVE BENEFIT CORPORATION 2023-12-28 US claimed
EP-3078717-B1 PHOTOBASE GENERATOR SAN APRO LTD (JP) 2020-05-20 EP claimed
US-20130165428-A1 XANTHINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2013-06-27 US claimed
US-20120252782-A1 Xanthine Derivatives, the Preparation Thereof and Their Use as Pharmaceutical Compositions BOEHRINGER INGELHEIM PHARMA GMBH AND CO. KG (DE) 2012-10-04 US claimed
US-20120035158-A1 Xanthine Derivatives, the Preparation Thereof and Their Use as Pharmaceutical Compositions BOEHRINGER INGELHEIM PHARMA GMBH AND CO. KG (DE) 2012-02-09 US claimed
US-20110144083-A1 Xanthine Derivatives, the Preparation Thereof and Their Use as Pharmaceutical Compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-06-16 US claimed
EP-2298769-A1 Xanthin derivatives, their production and utilisation as medicine Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2011-03-23 EP claimed
US-20100173916-A1 Xanthine Derivatives, the Preparation Thereof and Their Use as Pharmaceutical Compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-07-08 US claimed
US-7569574-B2 Purine derivatives, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-08-04 US claimed
EP-1101759-A1 PHENYLAZOLE COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND DRUGS FOR HYPERLIPEMIA NIPPON SODA CO., LTD. (JP) 2001-05-23 EP claimed
US-5804601-A USEFUL FOR TREATING ALZHEIMER'S DISEASE, MULTIPLE SCLEROSIS, BACTERIAL OR VIRAL MENINGITIS, DOWN'S SYNDROME AND PARKINSON'S DISEASE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-08 US claimed
EP-0737671-A2 Aromatic hydroxamic acid compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1996-10-16 EP claimed
US-4140681-A ANTICOAGULANTS MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1979-02-20 US claimed
US-4131673-A INHIBITION AND SUPPRESSION OF THROMBOSIS IN MAMMALS MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1978-12-26 US claimed
US-4125604-A PEPTIDES, ANTITHROMBOSIS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1978-11-14 US claimed
US-4101653-A ANTITHROMBOSIS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1978-07-18 US claimed
US-4097472-A INHIBITION AND SUPRESSION OF THROMBOSIS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JA) 1978-06-27 US claimed
US-4093712-A ANTITHROMBOGENIC AGENTS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JA) 1978-06-06 US claimed
US-4066773-A ANTITHROMBOSIS MITSUBISHI CHEMICAL INDUSTRIES LTD. (JA) 1978-01-03 US 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 (5 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-20110144083-A1 Xanthine Derivatives, the Preparation Thereof and Their Use as Pharmaceutical Compositions DPP4, DPP3, DPP7 IDO1 418/4885CDC25B 4241/4885MAOA 409/4885
US-20130165428-A1 XANTHINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS PHARMACEUTICAL COMPOSITIONS DPP4, DPP3, DPP7 IDO1 418/4885CDC25B 4241/4885MAOA 409/4885
US-20100173916-A1 Xanthine Derivatives, the Preparation Thereof and Their Use as Pharmaceutical Compositions DPP4, DPP3, DPP7 IDO1 418/4885CDC25B 4241/4885MAOA 409/4885
US-20120035158-A1 Xanthine Derivatives, the Preparation Thereof and Their Use as Pharmaceutical Compositions DPP4, DPP3, DPP7 IDO1 418/4885CDC25B 4241/4885MAOA 409/4885
US-20120252782-A1 Xanthine Derivatives, the Preparation Thereof and Their Use as Pharmaceutical Compositions DPP4, DPP3, DPP7 IDO1 418/4885CDC25B 4241/4885MAOA 409/4885

“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.