SCHEMBL14726431

SCHEMBL14726431

Cc1cc(OCc2ccccc2)c(OCc2ccccc2)nn1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
MAPK1 P28482 2/20 0.51
MAPT P10636 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
HTT P42858 3/20 0.49
STAT3 P40763 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
BRD4 O60885 5/20 0.48
LIPE Q05469 1/20 0.44
LMNA P02545 3/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LTA4H P09960 1/20 0.42
MAPK14 Q16539 1/20 0.42
FFAR4 Q5NUL3 1/20 0.41
SQOR Q9Y6N5 1/20 0.41
ALOX5AP P20292 1/20 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
SCHEMBL19597969 0.83 NPC1 (0.48) HTTLMNAALDH1A1NPSR1
SCHEMBL11108539 0.82 LTA4H (0.53) L3MBTL1MAPK1MAPTTDP1HTT
SCHEMBL15837402 0.81 L3MBTL1 (0.44) L3MBTL1MAPK1MAPTTDP1HTT
SCHEMBL16231687 0.81 L3MBTL1 (0.45) L3MBTL1MAPK1MAPTTDP1HTT
SCHEMBL14719395 0.80 SLC6A4 (0.44) L3MBTL1MAPK1MAPTTDP1HTT
SCHEMBL14729707 0.80 SQOR (0.51) L3MBTL1MAPK1MAPTTDP1HTT
SCHEMBL15837139 0.80 MPO (0.50) L3MBTL1MAPK1MAPTTDP1HTT
SCHEMBL14718731 0.80 HTR2C (0.43) L3MBTL1MAPK1MAPTTDP1HTT
SCHEMBL15821308 0.80 L3MBTL1 (0.44) L3MBTL1MAPK1MAPTTDP1HTT
SCHEMBL14719551 0.79 L3MBTL1 (0.44) L3MBTL1MAPK1MAPTTDP1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10202399-B2 Dihydroxy aromatic heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-02-12 US disclosed
US-20180177780-A1 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-06-28 US disclosed
US-9931340-B2 Pyridazinone compounds and their use as DAAO inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-04-03 US disclosed
EP-2748149-B9 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS TAKEDA PHARMACEUTICALS CO (JP) 2017-11-15 EP disclosed
US-20170173007-A1 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-06-22 US disclosed
US-20170107226-A1 DIHYDROXY AROMATIC HETEROCYCLIC COMPOUND ASTELLAS PHARMA INC. (JP) 2017-04-20 US disclosed
US-9290456-B2 Pyridazinone compounds and their use as DAAO inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-03-22 US disclosed
US-20150030704-A1 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-01-29 US disclosed
US-20130052281-A1 NOVEL COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-28 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 (6 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-20130052281-A1 NOVEL COMPOUNDS ABCG2, F12, UGT1A1 L3MBTL1 4060/4885MAPK1 3374/4885MAPT 2770/4885
US-20150030704-A1 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS PNPO, DAO, DPYD L3MBTL1 4285/4885MAPK1 1645/4885MAPT 2902/4885
US-20180177780-A1 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS PNPO, DAO, DPYD L3MBTL1 4285/4885MAPK1 1645/4885MAPT 2902/4885
US-10202399-B2 Dihydroxy aromatic heterocyclic compound DAO, DDO, DDC L3MBTL1 3346/4885MAPK1 1762/4885MAPT 2990/4885
US-20170173007-A1 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS PNPO, DAO, DPYD L3MBTL1 4285/4885MAPK1 1645/4885MAPT 2902/4885
US-20170107226-A1 DIHYDROXY AROMATIC HETEROCYCLIC COMPOUND DAO, DDO, DDC L3MBTL1 3346/4885MAPK1 1762/4885MAPT 2990/4885

“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.