SCHEMBL4136403

SCHEMBL4136403

CC(C)C(C)(O)C(=O)Nc1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 11/20 0.58
PGR P06401 2/20 0.50
CYP3A4 P08684 1/20 0.50
GRM4 Q14833 1/20 0.50
CYP2C19 P33261 1/20 0.47
ABCB11 O95342 1/20 0.47
ALB P02768 1/20 0.47
ADRA2C P18825 1/20 0.47
GHSR Q92847 1/20 0.47
CNR2 P34972 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
SCHEMBL4123404 0.87 AR (0.64) ARPGRCYP3A4GRM4CNR2
SCHEMBL9891509 0.85 AR (0.63) ARPGRCYP3A4GRM4CNR2
SCHEMBL8029788 0.82 AR (0.60) ARPGRCYP3A4GRM4CNR2
SCHEMBL8530877 0.82 AR (0.58) ARPGRCYP3A4GRM4CYP2C19
SCHEMBL9891902 0.81 AR (0.64) ARCYP3A4GRM4CYP2C19ABCB11
SCHEMBL4137272 0.81 AR (0.74) ARPGR
SCHEMBL4137264 0.81 AR (0.74) ARPGR
SCHEMBL8410375 0.80 AR (0.79) ARPGRCYP3A4CYP2C19ABCB11
SCHEMBL13695983 0.79 AR (0.54) AR
SCHEMBL463590 0.79 AR (0.62) ARGRM4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090226368-A1 Androgen-Receptor (AR) Ligands for Use in the Treatment and Diagnosis of AR-Related Pathologies MEDICAL RESEARCH FUND AT THE TEL AVIV SOURASKY MEDICAL CENTER (IL) 2009-09-10 US disclosed
EP-1957059-A1 ANDROGEN-RECEPTOR (AR) LIGANDS FOR USE IN THE TREATMENT AND DIAGNOSIS OF AR-RELATED PATHOLOGIES HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD. (IL) 2008-08-20 EP disclosed
WO-2007057909-A1 ANDROGEN-RECEPTOR (AR) LIGANDS FOR USE IN THE TREATMENT AND DIAGNOSIS OF AR-RELATED PATHOLOGIES HADASIT MEDICAL RESEARCH SERVICES & DEVELOPMENT LTD. (IL) 2007-05-24 WO 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-20090226368-A1 Androgen-Receptor (AR) Ligands for Use in the Treatment and Diagnosis of AR-Related Pathologies AR, SHBG, ESRRB AR 1/4885PGR 10/4885CYP3A4 2074/4885

“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.