SCHEMBL6804891

SCHEMBL6804891

Nc1nc(CC(=O)N2CCOc3cc(NC(=O)c4ccccc4-c4ccc(C(F)(F)F)cc4)ccc32)cs1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
GAA P10253 2/20 0.45
LMNA P02545 2/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
SMO Q99835 1/20 0.42
MTTP P55157 12/20 0.41
APOB P04114 9/20 0.41
HTT P42858 1/20 0.40
SCN9A Q15858 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
SCHEMBL6799658 0.88 KDM4E (0.46) KDM4EGAALMNAALDH1A1MAPT
SCHEMBL6804642 0.88 MTTP (0.47) KDM4EGAALMNAALDH1A1MAPT
SCHEMBL6809779 0.86 SMO (0.55) KDM4EGAALMNAALDH1A1MAPT
SCHEMBL6799088 0.82 KDM4E (0.46) KDM4EGAALMNAALDH1A1MAPT
SCHEMBL6806284 0.81 RIPK1 (0.43) LMNAMAPTSMN1; SMN2SMOMTTP
SCHEMBL6803373 0.80 KDM4E (0.40) KDM4EGAALMNAALDH1A1MAPT
SCHEMBL6804506 0.79 MTTP (0.48) KDM4ELMNASMOMTTPAPOB
SCHEMBL6794206 0.79 LMNA (0.60) LMNASMN1; SMN2SMOMTTPAPOB
SCHEMBL6802265 0.79 RIPK1 (0.42) LMNAALDH1A1MAPTSMN1; SMN2SMO
SCHEMBL6805417 0.79 SMO (0.47) KDM4EGAALMNAALDH1A1MAPT

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-20040157866-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 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-20040157866-A1 Amide compounds APOB, NR1H2, NR1H3 KDM4E 2600/4885GAA 2694/4885LMNA 956/4885

“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.