SCHEMBL2358271

SCHEMBL2358271

Cc1ccc(S(=O)(=O)n2c3c(c4c(Cl)c(F)ccc42)CCCC3=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.43
PTGS2 P35354 3/20 0.43
MAPT P10636 3/20 0.42
KDM4E B2RXH2 2/20 0.41
HTR6 P50406 4/20 0.38
ALDH1A1 P00352 3/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 2/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALDH3A1 P30838 2/20 0.34
MMP2 P08253 1/20 0.34
POLB P06746 1/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.34
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
RIPK3 Q9Y572 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
SCHEMBL2359637 0.89 MAPT (0.41) PTGS1PTGS2MAPTKDM4EHTR6
SCHEMBL14688409 0.82 ALDH1A1 (0.40) MAPTHTR6ALDH1A1GAASMN1; SMN2
SCHEMBL14688661 0.82 KDM4E (0.46) PTGS1PTGS2MAPTKDM4EHTR6
SCHEMBL2319772 0.81 KDM4E (0.49) PTGS1PTGS2MAPTKDM4EHTR6
SCHEMBL18804022 0.75 AR (0.45) PTGS1PTGS2HTR6ALDH1A1SMN1; SMN2
SCHEMBL2365407 0.74 HTR6 (0.46) PTGS1PTGS2MAPTKDM4EHTR6
SCHEMBL2359516 0.73 PTGS1 (0.44) PTGS1PTGS2MAPTKDM4EHTR6
SCHEMBL2358234 0.73 KDM4E (0.48) PTGS1PTGS2MAPTKDM4EHTR6
SCHEMBL14688468 0.72 HTR6 (0.39) KDM4EHTR6ALDH1A1GAASMN1; SMN2
SCHEMBL2359828 0.72 HTR6 (0.33) PTGS1PTGS2HTR6ALDH1A1GAA

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 15 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
EP-2531029-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS Radius Health, Inc. (US) 2012-12-12 EP 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 PTGS1 920/4885PTGS2 563/4885MAPT 2267/4885
US-20150266821-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS AR, SHBG, FSHR PTGS1 919/4885PTGS2 561/4885MAPT 2263/4885
US-20130041007-A1 Selective Androgen Receptor Modulators AR, SHBG, GPR119 PTGS1 1085/4885PTGS2 1033/4885MAPT 2494/4885

“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.