SCHEMBL12440436

SCHEMBL12440436

N=Nc1ccc(Cl)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.48
ITGB3 P05106 1/20 0.47
ITGAV P06756 1/20 0.47
TSHR P16473 6/20 0.44
CYP3A4 P08684 4/20 0.44
TDP1 Q9NUW8 3/20 0.44
MAPK1 P28482 2/20 0.44
HSD17B10 Q99714 2/20 0.42
LMNA P02545 3/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
IDO1 P14902 1/20 0.38
NR1I2 O75469 1/20 0.38
TTR P02766 1/20 0.38
PGR P06401 1/20 0.38
HSP90AA1 P07900 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
HSPA5 P11021 1/20 0.38

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
SCHEMBL11709281 0.80 TP53 (0.48) TP53ITGB3ITGAVTSHRCYP3A4
SCHEMBL11984875 0.76 ALDH1A1 (0.46) TP53TSHRCYP3A4MAPK1HSD17B10
SCHEMBL12440864 0.76 HTR2A (0.36) TP53ITGB3ITGAVTSHRCYP3A4
SCHEMBL31218219 0.75 TP53 (0.48) TP53ITGB3ITGAVTSHRCYP3A4
SCHEMBL9290659 0.75 TP53 (0.48) TP53ITGB3ITGAVTSHRCYP3A4
SCHEMBL1547648 0.75 TP53 (0.48) TP53ITGB3ITGAVTSHRCYP3A4
SCHEMBL13655841 0.73 TP53 (0.35) TP53TSHRCYP3A4TDP1MAPK1
SCHEMBL14701086 0.73 MEN1 (0.46) TP53ITGB3ITGAVTSHRCYP3A4
SCHEMBL11492006 0.73 TP53 (0.46) TP53ITGB3ITGAVTSHRCYP3A4
SCHEMBL11369080 0.71 ITGB3 (0.58) TP53ITGB3ITGAVTSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170121285-A1 Selective androgen receptor modulators RADIUS HEALTH INC (US) 2017-05-04 US disclosed
EP-2531029-B1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH INC (US) 2016-10-19 EP disclosed
US-20150266821-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH INC (US) 2015-09-24 US disclosed
US-8987319-B2 Selective androgen receptor modulators RADIUS HEALTH, INC. (US) 2015-03-24 US disclosed
US-20130041007-A1 Selective Androgen Receptor Modulators RADIUS HEALTH, INC. 2013-02-14 US disclosed
WO-2011097496-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2011-08-11 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 (3 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-20170121285-A1 Selective androgen receptor modulators AR, SHBG, FSHR TP53 1244/4885ITGB3 1598/4885ITGAV 1714/4885
US-20150266821-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS AR, SHBG, FSHR TP53 1247/4885ITGB3 1594/4885ITGAV 1725/4885
US-20130041007-A1 Selective Androgen Receptor Modulators AR, SHBG, GPR119 TP53 1188/4885ITGB3 913/4885ITGAV 1327/4885

“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.