SCHEMBL4169501

SCHEMBL4169501

CCS(=O)(=O)N1CCN(C(=O)CCCCCCCc2c(-c3ccccc3)n(CC(O)C(F)(F)F)c3ccc4[nH]c(=O)cc(Cl)c4c23)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.38
GAA P10253 1/20 0.33
TACR1 P25103 6/20 0.33
LMNA P02545 2/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
POLB P06746 1/20 0.32
NOX4 Q9NPH5 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TNKS O95271 1/20 0.31
PARP1 P09874 1/20 0.31
PARP2 Q9UGN5 1/20 0.31

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
SCHEMBL4169497 1.00 AR (0.38) ARGAATACR1LMNATP53
SCHEMBL4169610 0.85 AR (0.41) AR
SCHEMBL4169607 0.85 AR (0.41) AR
SCHEMBL4175137 0.81 AR (0.39) ARLMNA
SCHEMBL4183677 0.78 TACR1 (0.40) GAATACR1LMNATP53MAPT
SCHEMBL4134427 0.77 AR (0.53) ARTP53
SCHEMBL4134431 0.77 AR (0.53) ARTP53
SCHEMBL9885147 0.77 AR (0.53) ARTP53
SCHEMBL13697938 0.76 ADAMTS5 (0.34) GAAL3MBTL1
SCHEMBL4167737 0.75 AR (0.44) ARGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 US claimed
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 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-20090227571-A1 Androgen Receptor Modulator Compounds and Methods AR, NR5A1, ESRRA AR 1/4885GAA 4594/4885TACR1 151/4885

“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.