SCHEMBL1886907

SCHEMBL1886907

CN(C)CCN(C)c1ccc(C(=O)Nc2n[nH]c3c2CN(S(=O)(=O)c2cc(F)cc(F)c2)CC3(C)C)c(NC(=O)C2CCOCC2)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 9/20 0.39
IGF1R P08069 4/20 0.38
INSR P06213 1/20 0.38
ALK Q9UM73 1/20 0.38
NTRK3 Q16288 3/20 0.37
NTRK2 Q16620 3/20 0.37
CCNA2 P20248 4/20 0.35
CDK2 P24941 4/20 0.35
CCNA1 P78396 4/20 0.35
PRKCB P05771 2/20 0.35
PAK4 O96013 1/20 0.35
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
CCNE1 P24864 1/20 0.33
GSK3B P49841 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33

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
SCHEMBL1894294 0.96 NTRK1 (0.38) NTRK1IGF1RINSRALKNTRK3
SCHEMBL12673266 0.94 IGF1R (0.39) NTRK1IGF1RINSRALKNTRK3
SCHEMBL1886768 0.92 NTRK1 (0.43) NTRK1IGF1RNTRK3NTRK2CCNA2
SCHEMBL1895415 0.92 INSR (0.47) NTRK1IGF1RINSRALKNTRK3
SCHEMBL1889566 0.91 PAK4 (0.40) NTRK1IGF1RINSRALKNTRK3
SCHEMBL1883716 0.91 PAK4 (0.40) NTRK1IGF1RINSRALKNTRK3
SCHEMBL1894384 0.90 IGF1R (0.38) NTRK1IGF1RINSRALKNTRK3
SCHEMBL1371463 0.90 IGF1R (0.46) NTRK1IGF1RINSRALKNTRK3
SCHEMBL1888345 0.89 IGF1R (0.38) NTRK1IGF1RINSRALKNTRK3
SCHEMBL1888210 0.89 NTRK1 (0.42) NTRK1IGF1RNTRK3NTRK2CCNA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110230470-A1 SUBSTITUTED PYRAZOLO[4,3-C]PYRIDINE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-09-22 US disclosed
US-7947686-B2 Substituted pyrazolo[4,3-c]pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-05-24 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-20110230470-A1 SUBSTITUTED PYRAZOLO[4,3-C]PYRIDINE DERIVATIVES ACTIVE AS KINASE INHIBITORS MAP3K3, MAP3K1, MAP3K19 NTRK1 1131/4885IGF1R 760/4885INSR 922/4885

“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.