SCHEMBL590874

SCHEMBL590874

CN(C)C1CCN(c2ccc(C(=O)Nc3nn(C(c4ccccc4)(c4ccccc4)c4ccccc4)c4ccc(S(=O)(=O)c5cc(F)cc(F)c5)cc34)c([N+](=O)[O-])c2)CC1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SIRT6 Q8N6T7 4/20 0.34
WDR5 P61964 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
TRPV4 Q9HBA0 1/20 0.33
PDE6D O43924 2/20 0.33
INSR P06213 2/20 0.32
ALK Q9UM73 2/20 0.32
SFRP1 Q8N474 1/20 0.32
BCL2 P10415 1/20 0.32
BCL2L1 Q07817 1/20 0.32
SETD2 Q9BYW2 2/20 0.32
NSD2 O96028 1/20 0.32
IGF1R P08069 1/20 0.32
KIT P10721 1/20 0.32

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
SCHEMBL589594 0.91 ALK (0.39) TRPV4INSRALKSFRP1SETD2
SCHEMBL592048 0.91 SIRT6 (0.42) SIRT6WDR5INSRALKIGF1R
SCHEMBL590468 0.88 SIRT6 (0.40) SIRT6WDR5INSRALKIGF1R
SCHEMBL591802 0.86 SIRT6 (0.43) KMT2ASIRT6INSRALKIGF1R
SCHEMBL590368 0.86 ALK (0.35) MEN1KMT2ASIRT6INSRALK
SCHEMBL591915 0.85 TRPV4 (0.32) KMT2ATRPM8TRPV4SFRP1BCL2
SCHEMBL591187 0.83 LMNA (0.34) MEN1KMT2ATRPM8TRPV4INSR
SCHEMBL590839 0.83 INSR (0.40) PLK1MEN1KMT2ASIRT6TRPM8
SCHEMBL590446 0.82 ABCC9 (0.32) MEN1KMT2ATRPM8TRPV4ALK
SCHEMBL592137 0.81 ALK (0.48) INSRALKIGF1RKIT

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-2120932-B1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES SRL (IT) 2014-07-09 EP disclosed
US-8114865-B2 Indazole derivatives as kinase inhibitors for the treatment of cancer NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-02-14 US disclosed
US-20100197665-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-08-05 US disclosed
EP-2120932-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER Nerviano Medical Sciences S.r.l. (IT) 2009-11-25 EP disclosed
WO-2008074749-A9 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES SRL (IT) 2009-05-07 WO disclosed
WO-2008074749-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2008-06-26 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 (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-20100197665-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER MAP3K5, MAP3K19, MAP3K3 PLK1 47/4885MEN1 3368/4885KMT2A 1074/4885

“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.