SCHEMBL6001165

SCHEMBL6001165

COc1ccc(Oc2nc(-c3cccs3)nc3ccccc23)cc1F

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.54
MAPT P10636 9/20 0.54
LMNA P02545 6/20 0.54
L3MBTL1 Q9Y468 5/20 0.54
KMT2A Q03164 4/20 0.54
MAPK1 P28482 4/20 0.54
MEN1 O00255 3/20 0.54
ABCG2 Q9UNQ0 3/20 0.53
ABCB1 P08183 1/20 0.53
ABCC1 P33527 1/20 0.53
GBA1 P04062 7/20 0.51
ALDH1A1 P00352 6/20 0.51
HTT P42858 2/20 0.51
HPGD P15428 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL6001690 0.81 ABCG2 (0.59) KDM4EMAPTLMNAKMT2AMAPK1
SCHEMBL6001863 0.75 GBA1 (0.52) KDM4EMAPTLMNAL3MBTL1KMT2A
SCHEMBL6001192 0.73 MAPT (0.60) KDM4EMAPTLMNAL3MBTL1KMT2A
SCHEMBL38652052 0.70 KDM4E (0.47) KDM4EMAPTLMNAL3MBTL1KMT2A
SCHEMBL6001437 0.70 KDM4E (0.71) KDM4EMAPTLMNAKMT2AMAPK1
SCHEMBL6001181 0.69 IDO1 (0.47) KDM4EMAPTLMNAL3MBTL1KMT2A
SCHEMBL6001875 0.69 MEN1 (0.49) KDM4EMAPTLMNAL3MBTL1KMT2A
SCHEMBL9937522 0.68 MEN1 (1.00) KDM4EMAPTLMNAL3MBTL1KMT2A
SCHEMBL8844921 0.67 LTA4H (0.55) KDM4ELMNAL3MBTL1KMT2AMAPK1
SCHEMBL6001397 0.67 TDO2 (0.46) KDM4EMAPTLMNAL3MBTL1ABCG2

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-20060128702-A1 Heterocyclic and bicyclic compounds, compositions and methods REDDY US THERAPEUTICS, INC. 2006-06-15 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-20060128702-A1 Heterocyclic and bicyclic compounds, compositions and methods HPSE, ENGASE, UGCG KDM4E 2893/4885MAPT 4070/4885LMNA 706/4885

“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.