SCHEMBL4633983

SCHEMBL4633983

[O]n1nc2ccccc2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.48
KDM4E B2RXH2 4/20 0.48
MAPT P10636 7/20 0.42
HTT P42858 1/20 0.37
TSHR P16473 2/20 0.36
GPR3 P46089 1/20 0.36
ALDH1A1 P00352 7/20 0.35
HSD17B10 Q99714 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
GLA P06280 1/20 0.35
ACHE P22303 1/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NQO2 P16083 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PLAUR Q03405 1/20 0.32
MAPK1 P28482 2/20 0.32

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
SCHEMBL31031292 0.73 KDM4E (0.52) HPGDKDM4EMAPTHTTTSHR
Phosphoric Acid SCHEMBL3486089 0.71 KDM4E (0.44) HPGDKDM4EMAPTHTTALDH1A1
SCHEMBL5255216 0.69 HPGD (0.42) HPGDKDM4EMAPTHTTTSHR
SCHEMBL25508860 0.69 KDM4E (0.42) HPGDKDM4EMAPTHTTTSHR
SCHEMBL822547 0.69 SLC9A1 (0.48) HPGDKDM4EMAPTHTTGPR3
SCHEMBL2930623 0.69 HPGD (0.48) HPGDKDM4EMAPTHTTTSHR
SCHEMBL17832517 0.69 HPGD (0.48) HPGDKDM4EMAPTHTTTSHR
SCHEMBL2306803 0.69 KDM4E (0.48) HPGDKDM4EMAPTHTTTSHR
SCHEMBL103176 0.69 KDM4E (0.55) HPGDKDM4EMAPTHTTTSHR
SCHEMBL2022886 0.69 KDM4E (0.48) HPGDKDM4EMAPTHTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7405030-B2 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2008-07-29 US disclosed
EP-1930339-A2 Imide compound MITSUI CHEMICALS, INC. (JP) 2008-06-11 EP disclosed
US-20070259151-A1 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2007-11-08 US disclosed
US-7259260-B2 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2007-08-21 US disclosed
US-20050208425-A1 Imide compound and optical recording media made by using the same YAMAMOTO CHEMICALS, INC. (JP) 2005-09-22 US disclosed
EP-1180765-B1 Optical recording medium and porphycene compound MITSUI CHEMICALS INC (JP) 2005-04-06 EP disclosed
EP-1445115-A1 IMIDE COMPOUNDS AND OPTICAL RECORDING MEDIA MADE BY USING THE SAME Mitsui Chemicals, Inc. (JP) 2004-08-11 EP disclosed
US-6627288-B1 Optical recording medium and porphycene compound MITSUI CHEMICALS, INC. (JP) 2003-09-30 US disclosed
EP-1180765-A1 Optical recording medium and porphycene compound Mitsui Chemicals, Inc. (JP) 2002-02-20 EP disclosed
US-4436828-A Reactive asymmetrical dicarboxylic acid esters and reagents for the investigation of cardiac glycosides BOEHRINGER MANNHEIM GMBH (DE) 1984-03-13 US disclosed
US-4436828-A Reactive asymmetrical dicarboxylic acid esters and reagents for the investigation of cardiac glycosides BOEHRINGER MANNHEIM GMBH (DE) 1984-03-13 US disclosed
US-4282151-A Reactive asymmetrical dicarboxylic acid esters and reagents for the investigation of cardiac glycosides BOEHRINGER MANNHEIM GMBH (DE) 1981-08-04 US disclosed
US-4282151-A Reactive asymmetrical dicarboxylic acid esters and reagents for the investigation of cardiac glycosides BOEHRINGER MANNHEIM GMBH (DE) 1981-08-04 US disclosed
US-4133949-A Dicarboxylic acid esters of cardiac glycosides BOEHRINGER MANNHEIM GMBH (DE) 1979-01-09 US disclosed
US-4133949-A Dicarboxylic acid esters of cardiac glycosides BOEHRINGER MANNHEIM GMBH (DE) 1979-01-09 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-20050208425-A1 Imide compound and optical recording media made by using the same CRY1, MTNR1A, TRPA1 HPGD 3323/4885KDM4E 3011/4885MAPT 2420/4885

“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.