SCHEMBL1889044

SCHEMBL1889044

NC(=O)c1cc(N2CCOCC2)c(N2CCC[C@H]2C(=O)O)cc1C(=O)Nc1n[nH]c2c1CN(S(=O)(=O)c1cc(F)cc(F)c1)CC2

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.50
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 5/20 0.34
NPSR1 Q6W5P4 3/20 0.34
HPGD P15428 2/20 0.34
NTRK1 P04629 2/20 0.33
NTRK3 Q16288 2/20 0.33
NTRK2 Q16620 2/20 0.33
HTT P42858 3/20 0.32
KDM4E B2RXH2 3/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
KDM4C Q9H3R0 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
SCHEMBL1895960 1.00 IGF1R (0.50) IGF1RRAB9AALDH1A1NPSR1HPGD
SCHEMBL1892757 0.98 IGF1R (0.49) IGF1RRAB9AALDH1A1NPSR1HPGD
SCHEMBL1883600 0.92 IGF1R (0.59) IGF1RNTRK1NTRK3NTRK2
SCHEMBL1892782 0.92 IGF1R (0.59) IGF1RNTRK1NTRK3NTRK2
SCHEMBL1888988 0.90 IGF1R (0.58) IGF1RNTRK1NTRK3NTRK2
SCHEMBL1889646 0.90 IGF1R (0.53) IGF1RRAB9AALDH1A1NPSR1HPGD
SCHEMBL1896379 0.90 IGF1R (0.50) IGF1RRAB9AALDH1A1NPSR1HPGD
SCHEMBL1891602 0.88 NTRK1 (0.40) IGF1RRAB9AALDH1A1NPSR1HPGD
SCHEMBL1891387 0.88 NTRK1 (0.40) IGF1RRAB9AALDH1A1NPSR1HPGD
SCHEMBL1889972 0.87 IGF1R (0.49) 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 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 760/4885RAB9A 1056/4885ALDH1A1 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.