SCHEMBL9302285

SCHEMBL9302285

CN(C(=O)c1cc(=O)[nH]c2ccc(O)cc12)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.47
ALDH1A1 P00352 6/20 0.44
KDM4E B2RXH2 6/20 0.44
POLB P06746 4/20 0.44
GAA P10253 4/20 0.44
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CASP6 P55212 1/20 0.43
MAOB P27338 1/20 0.42
HPGD P15428 4/20 0.42
HSD17B10 Q99714 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
MAPK10 P53779 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GLA P06280 1/20 0.41
HSP90AA1 P07900 2/20 0.41

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
SCHEMBL9302896 0.92 HSP90AA1 (0.46) PTGS2ALDH1A1KDM4EPOLBGAA
SCHEMBL9182334 0.79 KMT2A (0.48) PTGS2ALDH1A1KDM4EPOLBGAA
SCHEMBL28982768 0.77 KDM4E (0.63) PTGS2ALDH1A1KDM4EPOLBGAA
SCHEMBL9806551 0.73 PDK2 (0.70) ALDH1A1KDM4EPOLBGAATDP1
SCHEMBL9410533 0.73 PTGS2 (0.40) PTGS2ALDH1A1KDM4EPOLBGAA
SCHEMBL28219703 0.72 ALDH1A1 (0.50) PTGS2ALDH1A1KDM4EGAAMEN1
SCHEMBL9410532 0.72 SMAD3 (0.59)
SCHEMBL9185831 0.72 MEN1 (0.49) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL4659413 0.70 MEN1 (0.67) ALDH1A1KDM4EPOLBGAATDP1
SCHEMBL11097088 0.69 GAA (0.73) ALDH1A1KDM4EPOLBGAATDP1

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
US-5310913-A Immunomodulators KABI PHARMACIA AKTIEBOLAG (SE) 1994-05-10 US claimed