SCHEMBL9959232

SCHEMBL9959232

Cc1c(C(F)(F)F)n(C(F)(F)F)c2ccc3[nH]c(=O)cc(Cl)c3c12

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AR P10275 13/20 0.60
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.34
MAPK14 Q16539 1/20 0.33
MALT1 Q9UDY8 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
TP53 P04637 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PDPK1 O15530 1/20 0.33

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
SCHEMBL4138853 0.83 AR (0.74) ARLMNA
SCHEMBL4138480 0.81 AR (0.62) ARLMNA
SCHEMBL4130936 0.79 AR (0.56) ARMALT1
SCHEMBL17416811 0.78 AR (0.53) ARLMNAMAPTMAPK14TNKS2
SCHEMBL17416810 0.78 AR (0.53) ARLMNAMAPTTNKS2TP53
SCHEMBL4142951 0.76 AR (0.71) ARLMNAPDPK1
SCHEMBL4131580 0.75 AR (0.51) ARLMNAMAPTTNKS2TP53
SCHEMBL4147947 0.75 AR (0.77) ARLMNA
SCHEMBL31584718 0.75 AR (1.00) ARLMNA
SCHEMBL4130914 0.75 AR (1.00) ARLMNA

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-8580811-B2 Androgen receptor modulator methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2013-11-12 US disclosed
US-20120165362-A1 Androgen receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED 2012-06-28 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-20120165362-A1 Androgen receptor modulator compounds and methods AR, NR5A1, ESRRA AR 1/4885LMNA 3994/4885MAPT 4308/4885

“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.