SCHEMBL2769356

SCHEMBL2769356

Cc1cc(NCC(C)(O)C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)ccc1[N+](=O)[O-]

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AR P10275 8/20 0.55
ALDH1A1 P00352 1/20 0.52
MEN1 O00255 1/20 0.52
MAPT P10636 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
PGR P06401 1/20 0.51
CYP3A4 P08684 1/20 0.51

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
SCHEMBL2766432 0.92 AR (0.57) ARALDH1A1MEN1MAPTRAB9A
SCHEMBL2766745 0.90 AR (0.56) ARPGRCYP3A4
SCHEMBL5683099 0.89 AR (0.47) ARALDH1A1MEN1MAPTRAB9A
SCHEMBL2767783 0.89 AR (0.47) ARALDH1A1MEN1MAPTRAB9A
SCHEMBL15304162 0.87 AR (0.57) ARALDH1A1MEN1MAPTRAB9A
SCHEMBL14522367 0.87 AR (0.57) ARALDH1A1MEN1MAPTRAB9A
SCHEMBL2767043 0.87 AR (0.51) AR
SCHEMBL27630713 0.87 AR (0.57) ARPGRCYP3A4
SCHEMBL27650930 0.86 AR (0.72) ARALDH1A1MEN1MAPTRAB9A
SCHEMBL2765554 0.86 AR (0.72) ARALDH1A1MEN1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1641745-B1 PROPIONAMIDE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS ORION CORP (FI) 2010-04-14 EP disclosed
CN-100462353-C Propionamide derivatives useful as androgen receptor modulators ORION CORP (FI) 2009-02-18 CN disclosed
US-7390923-B2 Propionamide derivatives useful as androgen receptor modulators ORION CORPORATION (FI) 2008-06-24 US disclosed
US-20070123512-A1 Propionamide derivatives useful as androgen receptor modulators ORION CORPORATION (FI) 2007-05-31 US disclosed
CN-1812961-A Propionamide derivatives useful as androgen receptor modulators ORION CORP (FI) 2006-08-02 CN disclosed
EP-1641745-A1 PROPIONAMIDE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS Orion Corporation (FI) 2006-04-05 EP disclosed
WO-2005000794-A1 PROPIONAMIDE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS ORION CORPORATION (FI) 2005-01-06 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 (1 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-20070123512-A1 Propionamide derivatives useful as androgen receptor modulators NR5A1, FSHR, GNRHR AR 4/4885ALDH1A1 913/4885MEN1 2612/4885

“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.