SCHEMBL6799258

SCHEMBL6799258

O=C(Nc1ccc2c(c1)CCN2C(=O)Cc1cscn1)c1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMO Q99835 1/20 0.49
MTTP P55157 16/20 0.48
APOB P04114 9/20 0.47
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
TP53 P04637 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
SCHEMBL6663855 0.92 SRPK1 (0.43) SMOMTTPAPOBLMNAMAPT
SCHEMBL6804945 0.90 MAPT (0.46) LMNAALDH1A1MAPTTP53
SCHEMBL6804688 0.88 SMO (0.61) SMOMTTPAPOB
SCHEMBL6804697 0.87 SMO (0.54) SMOMTTPAPOB
SCHEMBL6804506 0.86 MTTP (0.48) SMOMTTPAPOBLMNAKDM4E
SCHEMBL6804642 0.86 MTTP (0.47) SMOMTTPAPOBLMNAKDM4E
SCHEMBL6805191 0.86 SMO (0.51) SMOMTTPAPOBLMNAKDM4E
SCHEMBL6804178 0.85 MTTP (0.52) SMOMTTPAPOBLMNAKDM4E
SCHEMBL6809825 0.85 SMO (0.50) SMOMTTPAPOBLMNAKDM4E
SCHEMBL6667700 0.85 SMO (0.49) SMOMTTPAPOBLMNAKDM4E

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 SMO 4390/4885MTTP 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.