SCHEMBL4766485

SCHEMBL4766485

Cc1cn(C(=O)O)c2c(Cl)ncc(C(=O)NC(C)(C)C)c12

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.36
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL3994387 0.86 NR3C1 (0.33) SYKPOLBAPEX1LMNAMAPT
SCHEMBL3988963 0.73 MEN1 (0.36) POLBLMNASMN1; SMN2
SCHEMBL12697387 0.71 POLB (0.45) SYKPOLBAPEX1LMNAMAPT
SCHEMBL3988980 0.71 CNR1 (0.39) POLBLMNASMN1; SMN2
SCHEMBL3989920 0.69 ACACB (0.42) LMNAMAPT
SCHEMBL5138223 0.68 CNR2 (0.40) LMNA
SCHEMBL4775541 0.67 USP30 (0.35) POLB
SCHEMBL13065416 0.67 SYK (0.48) SYKPOLBAPEX1SMN1; SMN2
SCHEMBL1035202 0.66 POLB (0.49) SYKPOLBAPEX1MAPTSMN1; SMN2
SCHEMBL4768472 0.66 NFKB1 (0.52) SYKPOLBAPEX1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753764-B1 PYRROLOPYRIDINE DERIVATIVES GLAXO GROUP LTD (GB) 2008-10-29 EP disclosed
EP-1753764-A1 PYRROLOPYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2007-02-21 EP disclosed
WO-2005121140-A1 PYRROLOPYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2005-12-22 WO disclosed