SCHEMBL459562

SCHEMBL459562

O=c1cc(O)c(Cl)cn1Cc1cccc(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
THRB P10828 1/20 0.47
BRD4 O60885 1/20 0.45
MKNK1 Q9BUB5 2/20 0.44
MKNK2 Q9HBH9 2/20 0.44
EGLN1 Q9GZT9 1/20 0.44
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
DPP4 P27487 1/20 0.43
HSD17B13 Q7Z5P4 1/20 0.42
DBH P09172 1/20 0.42
IDO1 P14902 1/20 0.41
P2RX7 Q99572 1/20 0.41
DAO P14920 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90B1 P14625 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
MAPT P10636 1/20 0.40

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
SCHEMBL460897 0.85 ALDH1A1 (0.48) THRBEGLN1LMNASMN1; SMN2ALDH1A1
SCHEMBL10080764 0.82 MAPT (0.44) POLBTHRBEGLN1LMNASMN1; SMN2
SCHEMBL460146 0.80 MAPT (0.55) LMNAP2RX7MAPT
SCHEMBL10080865 0.80 L3MBTL1 (0.56) BRD4EGLN1HSD17B13P2RX7
SCHEMBL4378877 0.75 MAPK14 (0.49) POLBTHRBLMNASMN1; SMN2ALDH1A1
SCHEMBL459682 0.74 MAPT (0.45) POLBTHRBEGLN1LMNASMN1; SMN2
SCHEMBL1770022 0.74 POLB (0.44) POLBTHRBBRD4MKNK1MKNK2
SCHEMBL3524356 0.73 HSD17B13 (0.47) POLBTHRBBRD4MKNK1MKNK2
SCHEMBL459616 0.73 MAPT (0.48) LMNAALDH1A1HSP90AA1MAPT
SCHEMBL1770079 0.73 POLB (0.48) POLBTHRBBRD4MKNK1MKNK2

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-2012011707-A2 SUBSTITUTED PYRIDINONE DERIVATIVES AND METHODS FOR MANUFACTURING THE SAME HYUNDAI PHARM CO., LTD. (KR) 2012-01-26 WO disclosed