SCHEMBL9268808

SCHEMBL9268808

Fc1ccc(Oc2cccc(Br)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
HTT P42858 1/20 0.47
F2 P00734 3/20 0.42
F10 P00742 3/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
ST14 Q9Y5Y6 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HTR7 P34969 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MAPK14 Q16539 1/20 0.37
HSPB1 P04792 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.36
GAA P10253 1/20 0.36
SCN9A Q15858 2/20 0.35
MAP4K4 O95819 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL8941507 0.85 MEN1 (0.50) MEN1KMT2AL3MBTL1HTTF2
SCHEMBL4286 0.82 F2 (0.46) MEN1KMT2AL3MBTL1HTTF2
SCHEMBL31026898 0.82 F2 (0.46) MEN1KMT2AL3MBTL1HTTF2
SCHEMBL10980485 0.81 HTT (0.47) MEN1KMT2AL3MBTL1HTTF2
SCHEMBL10985855 0.81 L3MBTL1 (0.50) MEN1KMT2AL3MBTL1HTTF2
SCHEMBL16034993 0.81 MAP4K4 (0.49) MEN1KMT2AF2F10PRSS1
SCHEMBL10566124 0.80 F2 (0.41) MEN1KMT2AL3MBTL1F2F10
SCHEMBL5346192 0.78 MEN1 (0.50) MEN1KMT2AL3MBTL1HTTF2
SCHEMBL9771223 0.78 MEN1 (0.47) MEN1KMT2AL3MBTL1HTTF2
SCHEMBL16695498 0.78 MEN1 (0.51) MEN1KMT2AL3MBTL1HTTF2

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3119760-A1 PIPERIDINE-DIONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2017-01-25 EP disclosed
US-20170001990-A1 PIPERIDINE-DIONE DERIVATIVES GENENTECH, INC. (US) 2017-01-05 US disclosed
US-20170001990-A1 PIPERIDINE-DIONE DERIVATIVES GENENTECH, INC. (US) 2017-01-05 US disclosed
US-20170001990-A1 PIPERIDINE-DIONE DERIVATIVES GENENTECH, INC. (US) 2017-01-05 US disclosed
WO-2015142903-A2 METHOD OF CONTROLLING LACTATE PRODUCTION WITH PIPERDINE-DIONE DERIVATIVES GENENTECH, INC. (US) 2015-09-24 WO disclosed
WO-2015140133-A1 PIPERIDINE-DIONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2015-09-24 WO disclosed
WO-2012150223-A1 NOVEL PYRIDINE METHYL ESTERS OF CYCLOPROPANE CARBOXYLIC ACID AS PEST CONTROL AGENTS BAYER CROPSCIENCE AG (DE) 2012-11-08 WO disclosed
WO-2012150207-A1 USE OF CYCLOPROPANECARBOXYLIC ACID ESTER DERIVATIVES FOR CONTROLLING INSECTICIDE-RESISTANT INSECTS BAYER CROPSCIENCE AG (DE) 2012-11-08 WO disclosed
WO-2012150207-A1 USE OF CYCLOPROPANECARBOXYLIC ACID ESTER DERIVATIVES FOR CONTROLLING INSECTICIDE-RESISTANT INSECTS BAYER CROPSCIENCE AG (DE) 2012-11-08 WO disclosed
WO-2012150223-A1 NOVEL PYRIDINE METHYL ESTERS OF CYCLOPROPANE CARBOXYLIC ACID AS PEST CONTROL AGENTS BAYER CROPSCIENCE AG (DE) 2012-11-08 WO disclosed
WO-1995007278-A1 FUNGICIDAL, MITICIDAL AND ARTHROPODICIDAL AMINOPYRIMIDINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-03-16 WO disclosed
US-4499275-A PESTICIDES; INSECTICIDES NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1985-02-12 US disclosed
US-4393213-A Process for producing 6-phenoxypicolinic aldehydes NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1983-07-12 US 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-20170001990-A1 PIPERIDINE-DIONE DERIVATIVES DRD4, ADORA1, ADORA3 MEN1 1242/4885KMT2A 2068/4885L3MBTL1 4289/4885

“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.