SCHEMBL4532324

SCHEMBL4532324

COC(=O)c1c[nH]c2cncc(Cl)c12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 11/20 0.62
CREBBP Q92793 1/20 0.45
AXL P30530 2/20 0.39
MAP2K1 Q02750 1/20 0.39
GAA P10253 2/20 0.38
TSHR P16473 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL9936887 0.82 NR4A2 (0.48) NR4A2CREBBPAXLMAP2K1GAA
SCHEMBL9937058 0.77 NR4A2 (1.00) NR4A2CREBBPMAP2K1LMNARAB9A
SCHEMBL1607800 0.71 NR4A2 (0.62) NR4A2CREBBPAXLMAP2K1GAA
SCHEMBL31753965 0.71 NR4A2 (0.62) NR4A2CREBBPAXLMAP2K1GAA
SCHEMBL25088402 0.71 NR4A2 (0.49) NR4A2CREBBPAXLMAP2K1
SCHEMBL14893447 0.70 ATM (0.49) NR4A2GAATSHRPDE4DALDH1A1
SCHEMBL6871302 0.70 NR4A2 (0.63) NR4A2CREBBPMAP2K1ALDH1A1MEN1
SCHEMBL9937275 0.70 NR4A2 (0.58) NR4A2CREBBPAXLMAP2K1
SCHEMBL17818802 0.70 NR4A2 (0.58) NR4A2CREBBPAXLMAP2K1
SCHEMBL24704112 0.70 MAP2K1 (0.42) NR4A2CREBBPAXLMAP2K1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009108551-A2 HETEROARYL AMIDE ANALOGUES H. LUNDBECK A/S (DK) 2009-09-03 WO disclosed