SCHEMBL5527140

SCHEMBL5527140

CC(C)N(C)C(=O)CNc1ccc(C#N)c(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.48
PGR P06401 2/20 0.48
CYP2C19 P33261 1/20 0.48
ABCB11 O95342 1/20 0.48
ALB P02768 1/20 0.48
ADRA2C P18825 1/20 0.48
GHSR Q92847 1/20 0.48
MAPT P10636 1/20 0.46
TAS2R14 Q9NYV8 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
SCHEMBL13748488 0.77 AR (0.50) ARPGRCYP2C19ABCB11ALB
SCHEMBL26986702 0.76 AR (0.51) ARMAPTTAS2R14
SCHEMBL3289361 0.76 AR (0.52) ARPGRCYP2C19ABCB11ALB
SCHEMBL3416477 0.76 AR (0.49) ARPGRCYP2C19ABCB11ALB
SCHEMBL3291274 0.75 AR (0.57) ARPGRCYP2C19ABCB11ALB
SCHEMBL4894829 0.75 AR (0.56) ARPGRCYP2C19ABCB11ALB
SCHEMBL3289311 0.74 AR (0.52) ARPGRTAS2R14
SCHEMBL26364991 0.74 AR (0.51) ARCYP2C19MAPTTAS2R14
SCHEMBL30104704 0.74 AR (0.51) ARCYP2C19MAPTTAS2R14
SCHEMBL20459116 0.74 AR (0.60) ARPGRCYP2C19ABCB11ALB

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-20070191479-A1 Aniline derivatives as selective androgen receptor modulators GLAXOSMITHKLINE LLC 2007-08-16 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-20070191479-A1 Aniline derivatives as selective androgen receptor modulators AR, NR3C2, NR5A1 AR 1/4885PGR 24/4885CYP2C19 201/4885

“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.