SCHEMBL9995253

SCHEMBL9995253

Nc1nc2ccc(F)cc2n1-c1ccc(Cl)nc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.40
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PIK3CD O00329 6/20 0.37
PIK3CA P42336 4/20 0.37
PIK3R1 P27986 4/20 0.37
PIK3CB P42338 4/20 0.37
PIK3CG P48736 4/20 0.37
POLB P06746 1/20 0.36
CYP11B1 P15538 2/20 0.36
CYP11B2 P19099 2/20 0.36
CYP1A2 P05177 1/20 0.36
METAP2 P50579 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MTOR P42345 1/20 0.34
MAPK14 Q16539 1/20 0.34

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
SCHEMBL9995271 0.80 KMT2A (0.47) MEN1KMT2APOLBCYP1A2
SCHEMBL17582837 0.77 GSR (0.45) GSRPIK3CAPOLBNPC1RAB9A
SCHEMBL9995322 0.77 HCAR1 (0.49) GSRMEN1KMT2APIK3CDPIK3CA
SCHEMBL9995321 0.72 THRB (0.37) GSRPIK3CAMTOR
SCHEMBL27912004 0.71 POLB (0.37) GSRPOLBCYP11B1CYP11B2
SCHEMBL16084455 0.70 AKT1 (0.43) MEN1KMT2APIK3CDPIK3CAPOLB
SCHEMBL16061226 0.70 CYP11B2 (0.39) GSRPOLBCYP11B1CYP11B2NPC1
SCHEMBL27486788 0.68 POLB (0.42) MEN1KMT2APIK3CDPOLB
SCHEMBL16084180 0.67 AKT1 (0.36) KMT2A
SCHEMBL30621949 0.66 CYP11B1 (0.50) GSRMEN1KMT2APOLBCYP11B1

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 6 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
US-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2013-04-11 US disclosed
WO-2011157787-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2011-12-22 WO 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 GSR 2101/4885MEN1 747/4885KMT2A 1942/4885

“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.