SCHEMBL1889780

SCHEMBL1889780

CN(C)CCNc1ccc(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 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PAK4 O96013 3/20 0.40
IGF1R P08069 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
NTRK1 P04629 5/20 0.36
LMNA P02545 4/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PKM P14618 1/20 0.35
NTRK3 Q16288 1/20 0.34
NTRK2 Q16620 1/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL1887219 1.00 PAK4 (0.40) PAK4IGF1RSMN1; SMN2NTRK1LMNA
SCHEMBL1894384 0.91 IGF1R (0.38) PAK4IGF1RNTRK1NTRK3NTRK2
SCHEMBL1889566 0.90 PAK4 (0.40) PAK4IGF1RNTRK1LMNAALDH1A1
SCHEMBL1883716 0.90 PAK4 (0.40) PAK4IGF1RNTRK1LMNAALDH1A1
SCHEMBL1888187 0.90 IGF1R (0.38) PAK4IGF1RNTRK1NTRK3NTRK2
SCHEMBL1893497 0.89 PAK4 (0.41) PAK4IGF1RSMN1; SMN2NTRK1LMNA
SCHEMBL1891495 0.89 PAK4 (0.41) PAK4IGF1RSMN1; SMN2NTRK1LMNA
SCHEMBL1886049 0.89 NTRK1 (0.42) PAK4IGF1RSMN1; SMN2NTRK1LMNA
SCHEMBL1892245 0.89 NTRK1 (0.42) PAK4IGF1RSMN1; SMN2NTRK1LMNA
SCHEMBL1890739 0.88 IGF1R (0.50) PAK4IGF1RSMN1; SMN2LMNANPC1

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 PAK4 44/4885IGF1R 760/4885SMN1; SMN2 3711/4885

“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.