SCHEMBL6808951

SCHEMBL6808951

O=C(Nc1ccc2c(c1)CCN2C(=O)Cc1cccnc1)c1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.54
CYP11B2 P19099 1/20 0.54
MTTP P55157 14/20 0.51
APOB P04114 9/20 0.51
HTR2A P28223 1/20 0.51
HTR2C P28335 1/20 0.51
SMO Q99835 1/20 0.48
EIF2AK3 Q9NZJ5 1/20 0.47
HIF1A Q16665 1/20 0.46
EPAS1 Q99814 1/20 0.46

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
SCHEMBL6804178 0.92 MTTP (0.52) CYP11B1CYP11B2MTTPAPOBSMO
SCHEMBL6666916 0.92 CYP11B1 (0.55) CYP11B1CYP11B2MTTPAPOBHTR2A
SCHEMBL6804697 0.89 SMO (0.54) MTTPAPOBHTR2AHTR2CSMO
SCHEMBL6804688 0.86 SMO (0.61) MTTPAPOBHTR2AHTR2CSMO
SCHEMBL6805191 0.85 SMO (0.51) MTTPAPOBSMO
SCHEMBL6647338 0.84 APOB (0.56) MTTPAPOBSMO
SCHEMBL6665703 0.84 CYP11B1 (0.49) CYP11B1CYP11B2MTTPAPOBHTR2A
SCHEMBL6644284 0.83 SMO (0.49) MTTPAPOBSMO
SCHEMBL6809825 0.82 SMO (0.50) MTTPAPOBSMO
SCHEMBL6667700 0.82 SMO (0.49) MTTPAPOBSMOEIF2AK3

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 CYP11B1 61/4885CYP11B2 96/4885MTTP 108/4885

“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.