SCHEMBL202986

SCHEMBL202986

C=C(C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.48
HTT P42858 1/20 0.48
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 4/20 0.46
GAA P10253 2/20 0.45
EPHX1 P07099 1/20 0.45
CTSV O60911 1/20 0.45
CTSL P07711 1/20 0.45
KMT2A Q03164 2/20 0.44
ATM Q13315 1/20 0.44
KDM4E B2RXH2 1/20 0.44
KCNMA1 Q12791 1/20 0.44
CYP19A1 P11511 1/20 0.44
RORC P51449 1/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL5629195 0.86 SMN1; SMN2 (0.60) PKMHTTMAPTSMN1; SMN2ALDH1A1
SCHEMBL17085330 0.83 PKM (0.68) PKMHTTMAPTSMN1; SMN2ALDH1A1
SCHEMBL6513296 0.82 ALDH1A1 (0.51) PKMHTTMAPTSMN1; SMN2ALDH1A1
SCHEMBL19268076 0.81 PIN1 (0.53) HTTMAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL2767301 0.81 HTT (0.63) HTTMAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL6160631 0.80 MAPT (0.72) PKMHTTMAPTSMN1; SMN2ALDH1A1
SCHEMBL13921949 0.80 CA12 (0.56) HTTMAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL12494510 0.79 ALDH1A1 (0.50) PKMHTTMAPTSMN1; SMN2ALDH1A1
SCHEMBL11997805 0.79 ALDH1A1 (0.50) PKMHTTMAPTSMN1; SMN2ALDH1A1
SCHEMBL6162009 0.78 PKM (0.53) PKMHTTMAPTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1817292-B1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA NV (BE) 2015-04-08 EP disclosed
US-8088811-B2 Heterocycle derivatives useful as selective androgen receptor modulators (SARMs) JANSSEN PHARMACEUTICA N.V. (BE) 2012-01-03 US disclosed
US-20100267670-A1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) ZHANG XUQING 2010-10-21 US disclosed
US-7781473-B2 Heterocycle derivatives useful as selective androgen receptor modulators (SARMS) J & J Pharmaceutical Research & Development, LLC. (US) 2010-08-24 US disclosed
US-20090131365-A1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) ZHANG XUQING 2009-05-21 US disclosed
US-7465809-B2 Heterocycle derivatives useful as selective androgen receptor modulators (SARMs) JANSSEN PHARMACEUTICA N.V. (BG) 2008-12-16 US disclosed
EP-1817292-A2 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2007-08-15 EP disclosed
US-20060211756-A1 Novel heterocycle derivatives useful as selective androgen receptor modulators (SARMs) JANSSEN PHARMACEUTICA N.V. (BE) 2006-09-21 US disclosed
WO-2006055184-A2 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-26 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-20060211756-A1 Novel heterocycle derivatives useful as selective androgen receptor modulators (SARMs) AR, NR5A1, NR5A2 PKM 466/4885HTT 2508/4885MAPT 2544/4885
US-20090131365-A1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) AR, NR5A1, NR5A2 PKM 466/4885HTT 2508/4885MAPT 2544/4885
US-20100267670-A1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) AR, NR5A1, NR5A2 PKM 466/4885HTT 2508/4885MAPT 2544/4885

“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.