SCHEMBL6804178

SCHEMBL6804178

O=C(Nc1ccc2c(c1)CCN2C(=O)Cc1ccncc1)c1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MTTP P55157 15/20 0.52
APOB P04114 9/20 0.52
SMO Q99835 1/20 0.51
CYP11B1 P15538 1/20 0.48
CYP11B2 P19099 1/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL6808951 0.92 CYP11B1 (0.54) MTTPAPOBSMOCYP11B1CYP11B2
SCHEMBL6665703 0.92 CYP11B1 (0.49) MTTPAPOBSMOCYP11B1CYP11B2
SCHEMBL6805191 0.90 SMO (0.51) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6804697 0.89 SMO (0.54) MTTPAPOBSMO
SCHEMBL6804688 0.89 SMO (0.61) MTTPAPOBSMO
SCHEMBL6647338 0.87 APOB (0.56) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6809825 0.87 SMO (0.50) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6644330 0.86 SMO (0.49) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6644284 0.86 SMO (0.49) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6802188 0.85 MTTP (0.52) MTTPAPOBSMOKDM4EALDH1A1

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 MTTP 108/4885APOB 1/4885SMO 4390/4885

“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.