SCHEMBL9995265

SCHEMBL9995265

Cc1cc(Nc2ccccc2[N+](=O)[O-])ccc1Br

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.61
KMT2A Q03164 5/20 0.61
RAB9A P51151 4/20 0.61
TDP1 Q9NUW8 3/20 0.58
MAPK1 P28482 3/20 0.58
ALDH1A1 P00352 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
CASP7 P55210 1/20 0.58
MAPT P10636 5/20 0.56
GAA P10253 2/20 0.56
PKM P14618 1/20 0.56
MAPK13 O15264 1/20 0.55
MAPK12 P53778 1/20 0.55
MAPK11 Q15759 1/20 0.55
MAPK14 Q16539 1/20 0.55
EPAS1 Q99814 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.48
LMNA P02545 1/20 0.48
ATM Q13315 1/20 0.48
LRRK2 Q5S007 1/20 0.46

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
SCHEMBL3908485 0.82 MEN1 (0.56) MEN1KMT2ARAB9ATDP1MAPK1
SCHEMBL1668970 0.80 EPAS1 (0.59) MEN1KMT2ARAB9ATDP1MAPK1
SCHEMBL11517583 0.80 ALDH1A1 (0.58) MEN1KMT2ARAB9ATDP1MAPK1
SCHEMBL4589324 0.80 MAPK13 (0.68) MEN1KMT2ARAB9ATDP1MAPK1
SCHEMBL11506844 0.79 ALDH1A1 (0.89) MEN1KMT2ARAB9ATDP1MAPK1
SCHEMBL338789 0.79 MAPK1 (0.74) MEN1KMT2ARAB9ATDP1MAPK1
SCHEMBL497223 0.79 MAPK1 (0.74) MEN1KMT2ARAB9ATDP1MAPK1
SCHEMBL14850454 0.78 MAPT (0.50) MEN1KMT2ARAB9AALDH1A1L3MBTL1
SCHEMBL7167600 0.78 TDP1 (0.79) MEN1KMT2ARAB9ATDP1MAPK1
SCHEMBL4589360 0.78 MAPK1 (0.55) MEN1KMT2ARAB9ATDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2582680-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES Novartis AG (CH) 2013-04-24 EP disclosed
US-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2013-04-11 US disclosed
US-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2013-04-11 US disclosed
CN-102947274-A Biphenyl substituted 1, 3-dihydro-benzoimidazol-2-ylideneamine derivatives NOVARTIS AG 2013-02-27 CN disclosed
WO-2011157787-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2011-12-22 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-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES IGF1R, IGFBP1, IGFBP2 MEN1 747/4885KMT2A 1942/4885RAB9A 2907/4885

“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.