SCHEMBL4186729

SCHEMBL4186729

CCCCCN(C)C(=O)CCCCCc1c(C)[nH]c2ccc3[nH]c(=O)cc(C(F)(F)F)c3c12

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AR P10275 14/20 0.42
ACHE P22303 2/20 0.42
BCHE P06276 1/20 0.40
SLC2A1 P11166 1/20 0.36
EPHX2 P34913 2/20 0.35

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
SCHEMBL4183113 1.00 AR (0.42) ARACHEBCHESLC2A1EPHX2
SCHEMBL4174163 0.88 ACHE (0.42) ARACHEBCHE
SCHEMBL4182274 0.85 AR (0.41) ARACHEBCHE
SCHEMBL4182498 0.83 AR (0.41) AR
SCHEMBL13697739 0.76 AR (0.53) AR
SCHEMBL4179060 0.71 AR (0.43) AR
SCHEMBL4172338 0.69 S1PR1 (0.47) AR
SCHEMBL4172748 0.68 AR (0.43) AR
SCHEMBL7286447 0.65 NPC1 (0.48) ACHEBCHEEPHX2
SCHEMBL23343387 0.65 EPHX2 (0.70) ACHEBCHEEPHX2

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 5 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
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 US disclosed
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 US disclosed
WO-2007005887-A2 ANDROGEN RECEPTOR MODULATOR COMPOUNDS, COMPOSITIONS AND USES THEREOF LIGAND PHARMACEUTICALS INCORPORATED (US) 2007-01-11 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-20090227571-A1 Androgen Receptor Modulator Compounds and Methods AR, NR5A1, ESRRA AR 1/4885ACHE 4523/4885BCHE 4103/4885

“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.