SCHEMBL2314949

SCHEMBL2314949

COc1ccc2ccccc2c1C=NN

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.73
HPGD P15428 2/20 0.73
MAPT P10636 4/20 0.55
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
MEN1 O00255 7/20 0.51
KMT2A Q03164 7/20 0.51
GAA P10253 4/20 0.51
ALDH1A1 P00352 4/20 0.51
RECQL P46063 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
POLB P06746 1/20 0.48
ATM Q13315 1/20 0.48
BACE1 P56817 1/20 0.45

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
SCHEMBL6522025 0.85 KDM4E (1.00) KDM4EHPGDMAPTMTNR1AMTNR1B
SCHEMBL10724211 0.85 KDM4E (1.00) KDM4EHPGDMAPTMTNR1AMTNR1B
SCHEMBL12787878 0.85 KDM4E (1.00) KDM4EHPGDMAPTMTNR1AMTNR1B
SCHEMBL9816957 0.83 KDM4E (0.97) KDM4EHPGDMAPTMTNR1AMTNR1B
SCHEMBL13583515 0.80 KDM4E (0.65) KDM4EHPGDMAPTMTNR1AMTNR1B
SCHEMBL16993697 0.79 KDM4E (0.63) KDM4EHPGDMAPTMEN1KMT2A
SCHEMBL16993698 0.79 KDM4E (0.63) KDM4EHPGDMAPTMEN1KMT2A
SCHEMBL3698427 0.79 KDM4E (0.63) KDM4EHPGDMAPTMTNR1AMTNR1B
SCHEMBL29708058 0.79 MAPT (0.68) KDM4EHPGDMAPTMTNR1AMTNR1B
SCHEMBL1002660 0.79 MAPT (0.68) KDM4EHPGDMAPTMTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110189306-A1 COMPOUNDS, COMPOSITIONS AND TREATMENTS FOR V-ATPase RELATED DISEASES KARTNER NORBERT 2011-08-04 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-20110189306-A1 COMPOUNDS, COMPOSITIONS AND TREATMENTS FOR V-ATPase RELATED DISEASES ATP6V1E1, ATP6V1G1, ATP6V1H KDM4E 2907/4885HPGD 373/4885MAPT 1563/4885

“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.