SCHEMBL1891391

SCHEMBL1891391

COc1ccc(C(=O)Nc2n[nH]c3c2CN(S(=O)(=O)c2cc(F)cc(F)c2)CC3(C)C)c(NC(=O)[C@@H]2CCCO2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
RAB9A P51151 2/20 0.42
LMNA P02545 3/20 0.42
PKM P14618 2/20 0.42
IGF1R P08069 3/20 0.40
NPC1 O15118 1/20 0.39
PAK4 O96013 2/20 0.38
MAPK1 P28482 3/20 0.38
HTT P42858 2/20 0.38
HPGD P15428 3/20 0.38
CCNA2 P20248 2/20 0.37
CDK2 P24941 2/20 0.37
CCNA1 P78396 2/20 0.37
KDM4E B2RXH2 3/20 0.37
HSD17B10 Q99714 2/20 0.37
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
CDK5 Q00535 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL1892030 1.00 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2RAB9ALMNAPKM
SCHEMBL1893365 0.91 IGF1R (0.40) ALDH1A1SMN1; SMN2RAB9ALMNAPKM
SCHEMBL1895613 0.91 IGF1R (0.40) ALDH1A1SMN1; SMN2RAB9ALMNAPKM
SCHEMBL1887859 0.91 IGF1R (0.46) ALDH1A1SMN1; SMN2LMNAPKMIGF1R
SCHEMBL1885576 0.91 IGF1R (0.46) ALDH1A1SMN1; SMN2LMNAPKMIGF1R
SCHEMBL1891495 0.90 PAK4 (0.41) ALDH1A1SMN1; SMN2RAB9ALMNAPKM
SCHEMBL1893497 0.90 PAK4 (0.41) ALDH1A1SMN1; SMN2RAB9ALMNAPKM
SCHEMBL1887692 0.90 IGF1R (0.40) ALDH1A1SMN1; SMN2LMNAIGF1RHPGD
SCHEMBL1892434 0.90 LMNA (0.45) ALDH1A1SMN1; SMN2RAB9ALMNAPKM
SCHEMBL1883266 0.90 LMNA (0.45) ALDH1A1SMN1; SMN2RAB9ALMNAPKM

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 ALDH1A1 2295/4885SMN1; SMN2 3711/4885RAB9A 1056/4885

“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.