SCHEMBL7569415

SCHEMBL7569415

CCCCC(=O)Nc1ccc(C(=O)O)cc1N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.60
ALDH1A1 P00352 6/20 0.60
GAA P10253 6/20 0.60
MAPT P10636 5/20 0.60
THRB P10828 3/20 0.60
HPGD P15428 3/20 0.60
HTT P42858 2/20 0.60
GFER P55789 2/20 0.60
PLEC Q15149 1/20 0.60
POLB P06746 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.52
RAB9A P51151 1/20 0.52
PTGER4 P35408 1/20 0.50
ERAP2 Q6P179 1/20 0.49
LNPEP Q9UIQ6 1/20 0.49
HSD17B10 Q99714 2/20 0.49
NPC1 O15118 1/20 0.49
GLA P06280 1/20 0.49
RCE1 Q9Y256 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL10584504 0.84 POLB (0.57) KDM4EALDH1A1MAPTTHRBHPGD
SCHEMBL7568209 0.84 HDAC3 (0.50) KDM4EALDH1A1GAAMAPTTHRB
SCHEMBL8396604 0.82 GAA (0.56) KDM4EALDH1A1GAAPOLBL3MBTL1
SCHEMBL27757715 0.81 HDAC1 (0.62) POLBHDAC3HDAC1HDAC2NCOR2
SCHEMBL7569087 0.81 SELL (0.62) KDM4EALDH1A1GAAMAPTHTT
SCHEMBL11380018 0.80 POLB (0.67) KDM4EALDH1A1HTTPOLB
SCHEMBL8085964 0.80 POLB (0.52) KDM4EALDH1A1GAAHPGDHTT
SCHEMBL9525197 0.79 KDM4E (0.72) KDM4EALDH1A1GAAMAPTTHRB
SCHEMBL10978862 0.79 HDAC3 (0.55) KDM4EALDH1A1GAAMAPTTHRB
SCHEMBL10978779 0.79 HDAC3 (0.55) KDM4EALDH1A1GAAMAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0685470-B1 Benzene derivatives and pharmaceutical composition KUREHA CHEMICAL IND CO LTD (JP) 2002-09-11 EP disclosed
EP-0685470-A2 Benzene derivatives and pharmaceutical composition Kureha Chemical Industry Co., Ltd. (JP) 1995-12-06 EP disclosed