SCHEMBL6804749

SCHEMBL6804749

CC1Cc2cc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)ccc2N1C(=O)Cc1ccccn1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMO Q99835 4/20 0.64
MTTP P55157 12/20 0.54
APOB P04114 11/20 0.54
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 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
SCHEMBL6664137 0.92 SMO (0.53) SMOMTTPAPOB
SCHEMBL6799538 0.87 SMO (0.63) SMOMTTPAPOBKDM4E
SCHEMBL6804688 0.84 SMO (0.61) SMOMTTPAPOB
SCHEMBL6804857 0.80 SMO (0.64) SMOMTTPAPOBKDM4EALDH1A1
SCHEMBL6792281 0.79 SMO (0.62) SMOMTTPAPOBALDH1A1LMNA
SCHEMBL6809779 0.79 SMO (0.55) SMOMTTPAPOBKDM4EALDH1A1
SCHEMBL6801590 0.79 SMO (0.54) SMOMTTPAPOBKDM4EALDH1A1
SCHEMBL6667139 0.79 SMO (0.52) SMOMTTPAPOB
SCHEMBL6803858 0.78 SMO (0.52) SMOMTTPAPOBMAPT
SCHEMBL6804505 0.78 SMO (0.52) SMOMTTPAPOBMAPT

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.