SCHEMBL9537786

SCHEMBL9537786

O=C(OCc1ccccc1)c1ccc(-c2ccc(C(=O)OCc3ccccc3)cc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.81
TDP1 Q9NUW8 4/20 0.81
SLC6A2 P23975 1/20 0.81
SLC6A3 Q01959 1/20 0.81
LMNA P02545 3/20 0.79
ALDH1A1 P00352 6/20 0.68
MAPT P10636 6/20 0.68
HPGD P15428 1/20 0.68
RAB9A P51151 4/20 0.64
NPC1 O15118 2/20 0.64
MEN1 O00255 1/20 0.63
GAA P10253 1/20 0.60
KDM4E B2RXH2 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.58
ESR1 P03372 1/20 0.57
ESR2 Q92731 1/20 0.57
SLC1A5 Q15758 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
MAPK1 P28482 1/20 0.53

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
SCHEMBL9537746 0.98 KMT2A (0.79) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL6393682 0.95 LMNA (0.90) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL312287 0.94 KMT2A (0.92) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL11692826 0.92 KMT2A (0.69) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL22080438 0.92 KMT2A (0.69) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL8469846 0.92 KMT2A (0.69) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL9331636 0.92 KMT2A (0.69) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL29163747 0.91 KMT2A (0.79) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL9369162 0.90 KMT2A (0.67) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL6029175 0.90 SLC6A2 (0.67) KMT2ATDP1SLC6A2SLC6A3LMNA

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-1993003012-A1 INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-02-18 WO disclosed