SCHEMBL220869

SCHEMBL220869

CCCc1c(N[C@@H](C(=O)NNC(=O)c2ccc(C#N)cc2)[C@H](C)O)ccc(C#N)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.38
PGR P06401 1/20 0.37
ALDH1A1 P00352 2/20 0.36
POLB P06746 2/20 0.36
CTDSP1 Q9GZU7 2/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TRPA1 O75762 2/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
RAB9A P51151 2/20 0.32
S1PR3 Q99500 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
SCHEMBL12140320 0.93 AR (0.39) ARPGRALDH1A1MEN1KMT2A
SCHEMBL1363123 0.93 AR (0.39) ARPGRALDH1A1MEN1KMT2A
SCHEMBL1363694 0.93 AR (0.39) ARPGRALDH1A1MEN1KMT2A
SCHEMBL12306118 0.93 AR (0.39) ARPGRALDH1A1MEN1KMT2A
SCHEMBL2760513 0.89 MEN1 (0.36) ARALDH1A1POLBCTDSP1GAA
SCHEMBL1364632 0.85 AR (0.52) ARPGRALDH1A1MEN1KMT2A
SCHEMBL1365820 0.85 AR (0.52) ARPGRALDH1A1MEN1KMT2A
SCHEMBL222718 0.85 AR (0.34) ARPGRALDH1A1POLBCTDSP1
SCHEMBL13748053 0.85 AR (0.39) ARPGRALDH1A1MEN1KMT2A
SCHEMBL12140396 0.85 AR (0.39) ARPGRALDH1A1MEN1KMT2A

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 4 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-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 1/4885PGR 54/4885ALDH1A1 1819/4885

“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.