SCHEMBL203521

SCHEMBL203521

CC(=O)Nc1ccc(C(C)=NN)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ L3MBTL1 Q9Y468 2/20 0.55
▸ HTT P42858 1/20 0.55
▸ ALDH1A1 P00352 7/20 0.55
▸ CA1 P00915 4/20 0.55
▸ CA2 P00918 4/20 0.55
▸ CA9 Q16790 4/20 0.55
▸ CA12 O43570 3/20 0.55
▸ MAPT P10636 4/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ BRD4 O60885 1/20 0.53
▸ NR1I2 O75469 1/20 0.53
▸ MB P02144 1/20 0.53
▸ CYP1A1 P04798 1/20 0.53
▸ CA3 P07451 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ RARG P13631 1/20 0.53
▸ TSHR P16473 1/20 0.53

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
SCHEMBL13985290 0.89 CA12 (0.56) SMN1; SMN2HTTALDH1A1CA1CA2
SCHEMBL13985287 0.84 KMT2A (0.56) SMN1; SMN2L3MBTL1HTTALDH1A1CA1
SCHEMBL19390434 0.83 PRSS1 (0.54) SMN1; SMN2L3MBTL1HTTALDH1A1CA1
SCHEMBL201420 0.80 ALDH1A1 (0.53) SMN1; SMN2L3MBTL1HTTALDH1A1CA1
SCHEMBL14253659 0.79 ALDH1A1 (0.65) SMN1; SMN2L3MBTL1HTTALDH1A1MAPT
SCHEMBL861674 0.78 SMN1; SMN2 (0.84) SMN1; SMN2L3MBTL1HTTALDH1A1CA1
SCHEMBL2906442 0.78 SMN1; SMN2 (0.61) SMN1; SMN2L3MBTL1HTTALDH1A1CA1
SCHEMBL474757 0.77 ALDH1A1 (0.70) SMN1; SMN2L3MBTL1HTTALDH1A1CA1
SCHEMBL29623006 0.77 SMN1; SMN2 (0.67) SMN1; SMN2L3MBTL1HTTALDH1A1CA1
SCHEMBL10768577 0.77 ALDH1A1 (0.68) SMN1; SMN2L3MBTL1HTTALDH1A1CA1

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 SMN1; SMN2 4074/4885L3MBTL1 4796/4885HTT 2508/4885
US-20090131365-A1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) AR, NR5A1, NR5A2 SMN1; SMN2 4074/4885L3MBTL1 4796/4885HTT 2508/4885
US-20100267670-A1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) AR, NR5A1, NR5A2 SMN1; SMN2 4074/4885L3MBTL1 4796/4885HTT 2508/4885

“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.

Send feedback