SCHEMBL223295

SCHEMBL223295

Cc1c(NC(C(=O)NNC(=O)c2ccc(C#N)cc2)C(C)(C)O)ccc(C#N)c1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.40
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MLYCD O95822 1/20 0.35
PDK1 Q15118 2/20 0.34
PDK2 Q15119 2/20 0.34
PDK3 Q15120 2/20 0.34
PDK4 Q16654 2/20 0.34
PGR P06401 3/20 0.34
RXFP1 Q9HBX9 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL223294 1.00 AR (0.40) ARMAOAMAOBMLYCDPDK1
SCHEMBL223737 0.92 AR (0.40) ARPGR
SCHEMBL223736 0.92 AR (0.40) ARPGR
SCHEMBL223991 0.87 AR (0.45) ARMAOAMAOBPDK1PDK2
SCHEMBL223992 0.87 AR (0.45) ARMAOAMAOBPDK1PDK2
SCHEMBL1364689 0.85 AR (0.38) ARMAOAMAOBMLYCDPGR
SCHEMBL1364954 0.85 AR (0.38) ARMAOAMAOBMLYCDPGR
SCHEMBL223682 0.80 AR (0.38) ARPGR
SCHEMBL223681 0.80 AR (0.38) ARPGR
SCHEMBL220763 0.80 AR (0.49) ARPDK1PDK2PDK3PDK4

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-8642632-B2 Selective androgen receptor modulators RADIUS HEALTH, INC. (US) 2014-02-04 US disclosed
US-20120004270-A1 Selective Androgen Receptor Modulators RADIUS HEALTH, INC. (US) 2012-01-05 US disclosed
US-20120004270-A1 Selective Androgen Receptor Modulators RADIUS HEALTH, INC. (US) 2012-01-05 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-20120004270-A1 Selective Androgen Receptor Modulators AR, NR3C2, NR5A1 AR 1/4885MAOA 4102/4885MAOB 3989/4885

“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.