SCHEMBL5558970

SCHEMBL5558970

CC(C(N)=O)n1c(=O)oc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.51
MAPK1 P28482 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
IDO1 P14902 1/20 0.45
USP2 O75604 1/20 0.44
TSHR P16473 1/20 0.44
ALDH1A1 P00352 5/20 0.43
MAPT P10636 1/20 0.43
HSD17B10 Q99714 1/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
POLB P06746 1/20 0.40
CBX7 O95931 1/20 0.40
CDYL2 Q8N8U2 1/20 0.40
CDYL Q9Y232 1/20 0.40
CDY1; CDY1B Q9Y6F8 1/20 0.40
CYP1A2 P05177 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
SCHEMBL18258621 0.86 IDO1 (0.50) HPGDMAPK1SMN1; SMN2IDO1USP2
SCHEMBL18258625 0.86 IDO1 (0.50) HPGDMAPK1SMN1; SMN2IDO1USP2
SCHEMBL11181874 0.83 ALDH1A1 (0.52) HPGDMAPK1SMN1; SMN2ALDH1A1MAPT
SCHEMBL2600306 0.80 MAPK1 (0.52) HPGDMAPK1SMN1; SMN2IDO1USP2
SCHEMBL29591678 0.80 MAPK1 (0.52) HPGDMAPK1SMN1; SMN2IDO1USP2
SCHEMBL20812687 0.77 MAPK1 (0.49) HPGDMAPK1SMN1; SMN2IDO1USP2
SCHEMBL11157197 0.73 MAPK1 (0.45) HPGDMAPK1SMN1; SMN2IDO1USP2
SCHEMBL27363652 0.73 MAPK1 (0.49) HPGDMAPK1SMN1; SMN2IDO1USP2
SCHEMBL27984706 0.73 POLB (0.47) HPGDMAPK1SMN1; SMN2ALDH1A1MAPT
SCHEMBL16984805 0.72 CDYL2 (0.44) HPGDSMN1; SMN2IDO1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756071-A1 BENZOXAZOLONE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES UCB, S.A. (BE) 2007-02-28 EP disclosed
WO-2005118561-A1 BENZOXAZOLONE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES UCB, S.A. (BE) 2005-12-15 WO disclosed
EP-1434765-A1 SUBSTITUTED PIPERIDINES WITH SELECTIVE BINDING TO HISTAMINE H3-RECEPTOR NOVO NORDISK A/S (DK) 2004-07-07 EP disclosed
WO-2003024929-A1 SUBSTITUTED PIPERIDINES WITH SELECTIVE BINDING TO HISTAMINE H3-RECEPTOR NOVO NORDISK A/S (DK) 2003-03-27 WO disclosed