SCHEMBL14688409

SCHEMBL14688409

Cc1ccc(S(=O)(=O)n2c3c(c4c(Cl)c(Cl)ccc42)CCC3=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
GAA P10253 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTR6 P50406 3/20 0.39
ALDH3A1 P30838 1/20 0.37
PKM P14618 2/20 0.37
MMP2 P08253 1/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 2/20 0.36
TP53 P04637 1/20 0.36
RECQL P46063 1/20 0.36
CXCL8 P10145 1/20 0.36
NOD2 Q9HC29 1/20 0.36
NOD1 Q9Y239 1/20 0.36
NPC1 O15118 1/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 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
SCHEMBL2359637 0.93 MAPT (0.41) ALDH1A1GAASMN1; SMN2HTR6ALDH3A1
SCHEMBL2359415 0.83 HTR6 (0.40) ALDH1A1GAASMN1; SMN2HTR6ALDH3A1
SCHEMBL14688468 0.82 HTR6 (0.39) ALDH1A1GAASMN1; SMN2HTR6ALDH3A1
SCHEMBL2365407 0.82 HTR6 (0.46) ALDH1A1GAASMN1; SMN2HTR6ALDH3A1
SCHEMBL2358271 0.82 PTGS1 (0.43) ALDH1A1GAASMN1; SMN2HTR6ALDH3A1
SCHEMBL2319772 0.75 KDM4E (0.49) ALDH1A1GAASMN1; SMN2HTR6PKM
SCHEMBL14701016 0.71 AR (0.44) ALDH1A1SMN1; SMN2HTR6PKMPOLB
SCHEMBL14688661 0.70 KDM4E (0.46) ALDH1A1GAASMN1; SMN2HTR6PKM
SCHEMBL18804045 0.69 AR (0.48) ALDH1A1SMN1; SMN2HTR6PKMHTT
SCHEMBL2360402 0.68 NOTUM (0.35) ALDH1A1MAPTTP53

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 13 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
US-20170121285-A1 Selective androgen receptor modulators RADIUS HEALTH INC (US) 2017-05-04 US disclosed
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-20150266821-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH INC (US) 2015-09-24 US 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-8987319-B2 Selective androgen receptor modulators RADIUS HEALTH, INC. (US) 2015-03-24 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
US-20130041007-A1 Selective Androgen Receptor Modulators RADIUS HEALTH, INC. 2013-02-14 US disclosed
US-20130041007-A1 Selective Androgen Receptor Modulators RADIUS HEALTH, INC. 2013-02-14 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 (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 ALDH1A1 1511/4885GAA 3270/4885SMN1; SMN2 736/4885
US-20150266821-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS AR, SHBG, FSHR ALDH1A1 1542/4885GAA 3263/4885SMN1; SMN2 728/4885
US-20130041007-A1 Selective Androgen Receptor Modulators AR, SHBG, GPR119 ALDH1A1 1091/4885GAA 3815/4885SMN1; SMN2 1034/4885

“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.