SCHEMBL5070001

SCHEMBL5070001

CN1C(=O)C2=C(c3ccccc3)N(C)C(=O)C2=C1c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.52
NR1H3 Q13133 2/20 0.52
PTGS2 P35354 3/20 0.50
ADK P55263 1/20 0.41
PDE4B Q07343 1/20 0.39
CASP3 P42574 1/20 0.39
BRD4 O60885 3/20 0.38
SIRT2 Q8IXJ6 1/20 0.38
SIRT1 Q96EB6 1/20 0.38
TTR P02766 1/20 0.38
CES1 P23141 1/20 0.38
FAAH O00519 1/20 0.38
MGLL Q99685 1/20 0.38
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
HTT P42858 1/20 0.37
CAMK2D Q13557 1/20 0.37
IDH1 O75874 1/20 0.36
HSD17B3 P37058 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL12725181 0.98 NR1H2 (0.50) NR1H2NR1H3PTGS2ADKPDE4B
SCHEMBL14620069 0.90 NR1H2 (0.45) NR1H2NR1H3PTGS2ADKPDE4B
SCHEMBL10050135 0.87 NR1H2 (0.42) NR1H2NR1H3PTGS2ADKBRD4
SCHEMBL10050133 0.85 ALDH1A1 (0.42) NR1H2NR1H3PTGS2SIRT2SIRT1
SCHEMBL9836026 0.82 PTGS2 (0.50) NR1H2NR1H3PTGS2CASP3TTR
SCHEMBL14275471 0.82 PTGS2 (0.44) NR1H2NR1H3PTGS2ADKCASP3
SCHEMBL9338640 0.82 STK10 (0.45) NR1H2NR1H3PDE4BLMNAMAPT
SCHEMBL794276 0.81 PTGS2 (0.69) NR1H2NR1H3PTGS2ADKPDE4B
SCHEMBL12394330 0.80 POLB (0.41) NR1H2NR1H3PTGS2BRD4SIRT2
SCHEMBL5110493 0.80 ALDH1A1 (0.40) NR1H2NR1H3PTGS2FAAHMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023171740-A1 COMPOSITE LIGHT EMISSION SIGNAL GENERATION MATERIAL FOR STATE SENSING, LIGHT-EMITTING SUBSTANCE CARRIER, INK FOR STATE SENSING, MEASUREMENT CHIP, AND ANALYSIS METHOD コニカミノルタ株式会社 2023-09-14 WO disclosed
US-20230050869-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 US disclosed
EP-3902021-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH Toyo Ink SC Holdings Co., Ltd. (JP) 2021-10-27 EP disclosed
US-20160049589-A1 DIKETOPYRROLOPYRROLE POLYMERS AS ORGANIC SEMICONDUCTORS BASF SE (DE) 2016-02-18 US disclosed
EP-1611207-B1 FLUORESCENT DIKETOPYRROLOPYRROLES BASF SE (DE) 2016-02-03 EP disclosed
US-9214258-B2 Semiconductor composites comprising carbon nanotubes and diketopyrrolopyrrole-thiophene based copolymers XEROX CORPORATION (US) 2015-12-15 US disclosed
US-20140158946-A1 SEMICONDUCTOR COMPOSITES COMPRISING CARBON NANOTUBES AND DIKETOPYRROLOPYRROLE-THIOPHENE BASED COPOLYMERS XEROX CORPORATION (US) 2014-06-12 US disclosed
US-8008507-B2 Fluorescent diketopyrrolopyrroles BASF SE Ludwigshafen (DE) 2011-08-30 US disclosed
US-20110204351-A1 NOVEL DIKETOPYRROLOPYRROLE POLYMERS HEIM INGO 2011-08-25 US disclosed
US-7982391-B2 Fluorescent compound selected from the derivatives of distyryl arylenes, oligoarylenes, nitrogen aromatic heterocyclic, sulfur heterocyclic, oxo substituted heterocyclic, triaryl amines FUJIFILM CORPORATION (JP) 2011-07-19 US disclosed
EP-0673940-A1 Pyrrolo (3,4-c) pyrroles substituted by cyaniminogroups CIBA-GEIGY AG (CH) 1995-09-27 EP disclosed
US-5382485-A Process for storing information CIBA-GEIGY CORPORATION (US) 1995-01-17 US disclosed
EP-0560727-A1 Information storage method CIBA-GEIGY AG (CH) 1993-09-15 EP disclosed
EP-0133156-B1 1,4-DIKETOPYRROLO-(3,4-C) PYRROLES CIBA-GEIGY AG (CH) 1991-07-10 EP disclosed
US-4760151-A Dithioketo pyrrolopyrroles CIBA-GEIGY CORPORATION (US) 1988-07-26 US disclosed
US-4666455-A Compositions pigmented with N-substituted 1,4-diketopyrrolo-[3,4-c]-pyrroles CIBA-GEIGY CORPORATION (US) 1987-05-19 US disclosed
US-4632893-A CHARGE GENERATING AND TRANSPORTING LAYERS; DARK RESISTANCE; POLYMERIC DYES CIBA-GEIGY CORPORATION (US) 1986-12-30 US disclosed
EP-0187620-A2 Dithioketo-pyrrolo-pyrroles, process for their preparation and use CIBA-GEIGY AG (CH) 1986-07-16 EP disclosed
US-4585878-A N-substituted 1,4-diketopyrrolo-[3,4-c]-pyrroles CIBA-GEIGY CORPORATION (US) 1986-04-29 US disclosed
EP-0133156-A2 1,4-Diketopyrrolo-(3,4-c) pyrroles CIBA-GEIGY AG (CH) 1985-02-13 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 (1 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-20160049589-A1 DIKETOPYRROLOPYRROLE POLYMERS AS ORGANIC SEMICONDUCTORS PIN1, PPOX, DDT NR1H2 2844/4885NR1H3 2668/4885PTGS2 2154/4885

“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.