SCHEMBL7567767

SCHEMBL7567767

CCCCC(=O)Nc1ccc(C(=O)O)cc1NCc1ccc(C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.51
POLB P06746 3/20 0.50
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 3/20 0.47
PKM P14618 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46

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
SCHEMBL7570411 0.92 POLB (0.47) HTTPOLBALDH1A1KDM4EPKM
SCHEMBL9422806 0.82 HTT (0.56) HTTPOLBALDH1A1KDM4EHDAC8
SCHEMBL7575469 0.80 BDKRB1 (0.44) HTTLTB4R
SCHEMBL7569087 0.79 SELL (0.62) HTTPOLBALDH1A1KDM4EHDAC3
SCHEMBL10584504 0.79 POLB (0.57) HTTPOLBALDH1A1KDM4EHDAC3
SCHEMBL7569415 0.78 KDM4E (0.60) HTTPOLBALDH1A1KDM4EHDAC3
SCHEMBL9422875 0.77 HTT (0.56) HTTPOLBALDH1A1KDM4EHDAC8
SCHEMBL7048020 0.76 PLK1 (0.55) POLBALDH1A1HDAC8L3MBTL1HPGD
SCHEMBL7569237 0.75 HTT (0.54) HTTPOLBALDH1A1KDM4EL3MBTL1
SCHEMBL7575179 0.75 HTT (0.54) HTTPOLBALDH1A1KDM4EL3MBTL1

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
EP-0685470-B1 Benzene derivatives and pharmaceutical composition KUREHA CHEMICAL IND CO LTD (JP) 2002-09-11 EP disclosed