SCHEMBL1889646

SCHEMBL1889646

NC(=O)c1cc(N2CCOCC2)c(N2CCC(C(=O)O)CC2)cc1C(=O)Nc1n[nH]c2c1CN(S(=O)(=O)c1cc(F)cc(F)c1)CC2

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 4/20 0.53
KMT2A Q03164 2/20 0.37
GAA P10253 2/20 0.37
RAB9A P51151 1/20 0.35
NTRK1 P04629 2/20 0.35
NTRK3 Q16288 2/20 0.35
NTRK2 Q16620 2/20 0.35
LMNA P02545 2/20 0.34
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CCNA1 P78396 1/20 0.33
HPGD P15428 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTT P42858 1/20 0.32
INSR P06213 1/20 0.32
ALK Q9UM73 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
SCHEMBL1896379 0.93 IGF1R (0.50) IGF1RKMT2AGAARAB9ANTRK1
SCHEMBL1889843 0.92 IGF1R (0.62) IGF1RGAANTRK1NTRK3NTRK2
SCHEMBL1895960 0.90 IGF1R (0.50) IGF1RKMT2ARAB9ANTRK1NTRK3
SCHEMBL1889044 0.90 IGF1R (0.50) IGF1RKMT2ARAB9ANTRK1NTRK3
SCHEMBL1892757 0.89 IGF1R (0.49) IGF1RKMT2ARAB9ANTRK1NTRK3
SCHEMBL1890091 0.89 IGF1R (0.52) IGF1RLMNACCNA2CDK2CCNA1
SCHEMBL1884864 0.87 NTRK1 (0.42) IGF1RKMT2AGAANTRK1NTRK3
SCHEMBL1890038 0.86 IGF1R (0.61) IGF1RNTRK1NTRK3NTRK2LMNA
SCHEMBL1893131 0.86 IGF1R (0.52) IGF1RKMT2AGAARAB9ANTRK1
SCHEMBL1888238 0.86 IGF1R (0.53) IGF1RKMT2ARAB9ANTRK1NTRK3

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 IGF1R 760/4885KMT2A 1468/4885GAA 1656/4885

“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.