SCHEMBL4098952

SCHEMBL4098952

CN(C)CCN(C)c1ccc(C(=O)Nc2[nH]nc3c2CN(S(=O)(=O)c2cc(F)cc(F)c2)CC3)c(C(N)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.41
AKR1C3 P42330 1/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
GFER P55789 1/20 0.32
NTRK1 P04629 2/20 0.32
BACE1 P56817 1/20 0.32
OPRM1 P35372 2/20 0.31
OPRD1 P41143 2/20 0.31
IKBKB O14920 1/20 0.31
MEN1 O00255 1/20 0.30
APAF1 O14727 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
CFTR P13569 1/20 0.30
ALK Q9UM73 1/20 0.30
C5AR1 P21730 1/20 0.30

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
SCHEMBL2678130 0.88 IGF1R (0.55) IGF1RAKR1C3NTRK1
SCHEMBL1885694 0.83 IGF1R (0.36) IGF1R
SCHEMBL2678342 0.80 NTRK1 (0.44) IGF1RNTRK1
SCHEMBL2678137 0.79 IGF1R (0.56) IGF1RAKR1C3NTRK1ALK
SCHEMBL2678541 0.78 IGF1R (0.59) IGF1RNTRK1
SCHEMBL4283865 0.77 IGF1R (0.49) IGF1RNTRK1
SCHEMBL1891964 0.76 IGF1R (0.42) IGF1RNTRK1ALK
SCHEMBL2679403 0.76 IGF1R (0.55) IGF1RAKR1C3NTRK1BACE1IKBKB
SCHEMBL2453861 0.75 IGF1R (0.54) IGF1RALDH1A1NTRK1OPRM1OPRD1
SCHEMBL2677466 0.75 IGF1R (0.54) IGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090023745-A1 Substituted Pyrazolo[4,3-c]Pyridine Derivatives Active as Kinase Inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-01-22 US 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-20090023745-A1 Substituted Pyrazolo[4,3-c]Pyridine Derivatives Active as Kinase Inhibitors MAP3K3, MAP3K1, MAP3K19 IGF1R 760/4885AKR1C3 1773/4885ALDH1A1 2295/4885

“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.