SCHEMBL4338832

SCHEMBL4338832

COC(=O)c1oc2cccc(Cl)c2c1N

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.61
ALDH1A1 P00352 6/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
HPGD P15428 3/20 0.56
HSD17B10 Q99714 2/20 0.49
TP53 P04637 1/20 0.49
HTT P42858 1/20 0.49
POLB P06746 1/20 0.45
NR4A2 P43354 2/20 0.44
AHR P35869 1/20 0.43
MAPK14 Q16539 1/20 0.41
GAA P10253 1/20 0.40
MAPK1 P28482 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
EDNRA P25101 1/20 0.39

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
SCHEMBL18496528 0.82 KDM4E (0.61) KDM4EALDH1A1SMN1; SMN2HPGDHSD17B10
SCHEMBL9432830 0.81 ALDH1A1 (0.51) KDM4EALDH1A1SMN1; SMN2HPGDHSD17B10
SCHEMBL22006830 0.78 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2HPGDHSD17B10
SCHEMBL1885241 0.76 KDM4E (1.00) KDM4EALDH1A1SMN1; SMN2HPGDHSD17B10
SCHEMBL30780353 0.76 NPC1 (0.63) KDM4EALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL4346053 0.75 NPSR1 (0.55) KDM4EALDH1A1SMN1; SMN2HPGDHSD17B10
SCHEMBL25752448 0.73 KDM4E (0.56) KDM4EALDH1A1SMN1; SMN2HPGDHSD17B10
SCHEMBL4484979 0.72 LMNA (0.45) KDM4EALDH1A1SMN1; SMN2HPGDHSD17B10
SCHEMBL22006944 0.72 KDM4E (0.79) KDM4EALDH1A1SMN1; SMN2HPGDHSD17B10
SCHEMBL4573629 0.72 KDM4E (1.00) KDM4EALDH1A1SMN1; SMN2HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200161564-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-05-21 US disclosed
WO-2009048274-A2 BENZOFURAN AND BENZOTHIOPHENE DERIVATIVES SUBSTITUTED WITH AMIDE, PROCESS FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2009-04-16 WO 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-20200161564-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OXER1, OR10J3, OCIAD1 KDM4E 4066/4885ALDH1A1 91/4885SMN1; SMN2 2012/4885

“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.