SCHEMBL6800720

SCHEMBL6800720

CC(=O)N1CCc2c1cc(C)c(NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1)c2C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
MTTP P55157 10/20 0.46
APOB P04114 6/20 0.46
ALDH1A1 P00352 2/20 0.44
GAA P10253 2/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
KLRK1 P26718 4/20 0.42
MICA Q29983 4/20 0.42
RAET1L Q5VY80 4/20 0.42
NOTUM Q6P988 1/20 0.42

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
SCHEMBL6663843 0.91 NOTUM (0.44) KDM4EMTTPAPOBGAALMNA
SCHEMBL6803527 0.85 SMO (0.47) KDM4EMTTPAPOB
SCHEMBL6801395 0.80 SMO (0.47) KDM4EMTTPAPOBALDH1A1GAA
SCHEMBL6809331 0.79 MTTP (0.46) KDM4EMTTPAPOBGAAKLRK1
SCHEMBL6804769 0.79 MTTP (0.62) KDM4EMTTPAPOBALDH1A1GAA
SCHEMBL6667054 0.77 SORT1 (0.40)
SCHEMBL14288688 0.77 MTTP (0.52) KDM4EMTTPAPOBALDH1A1GAA
SCHEMBL533119 0.75 MTTP (0.48) KDM4EMTTPAPOBALDH1A1GAA
SCHEMBL6665293 0.72 SORT1 (0.40) MTTPAPOB
SCHEMBL6669985 0.70 PARP10 (0.40) MTTPAPOBALDH1A1

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 2600/4885MTTP 108/4885APOB 1/4885

“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.