SCHEMBL4777248

SCHEMBL4777248

CCOC(=O)N1C=C(C(=O)OC(C)(C)C)C=CC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.36
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
ADORA1 P30542 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
IGF1R P08069 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
PREP P48147 1/20 0.31

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
SCHEMBL28970107 0.88 PREP (0.36) L3MBTL1MEN1KMT2AALDH1A1PREP
SCHEMBL5697477 0.80 NR1H2 (0.39) NFKB1NFKB2RELAL3MBTL1ALDH1A1
SCHEMBL28679752 0.72 ADORA1 (0.40) GLANFKB1NFKB2RELACRHBP
SCHEMBL17267602 0.70 ESR2 (0.38) NFKB1NFKB2RELAMEN1KMT2A
SCHEMBL30910213 0.69 ACHE (0.40) MEN1KMT2AALDH1A1
SCHEMBL28670678 0.68 GLA (0.39) GLANFKB1NFKB2RELACRHBP
SCHEMBL4777252 0.67 GLA (0.36) GLANFKB1NFKB2RELACRHBP
SCHEMBL13947269 0.65 TP53 (0.36) NFKB1NFKB2RELAMEN1KMT2A
SCHEMBL20670426 0.65 GLA (0.42) GLANFKB1NFKB2RELAADORA1
SCHEMBL4410627 0.64 GLA (0.39) GLANFKB1NFKB2RELAADORA1

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
EP-1968976-A1 SUBSTITUTED PYRAZOLO [4,3-C] PYRIDINE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2008-09-17 EP disclosed
WO-2007068619-A1 SUBSTITUTED PYRAZOLO [4,3-C] PYRIDINE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2007-06-21 WO disclosed