SCHEMBL5774639

SCHEMBL5774639

O=Cc1ccc(CCNC(=O)O)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.47
CNR1 P21554 1/20 0.46
ALDH1A1 P00352 3/20 0.44
PLAAT3 P53816 2/20 0.43
PLAAT5 Q96KN8 2/20 0.43
PLAAT2 Q9NWW9 2/20 0.43
PLAAT4 Q9UL19 2/20 0.43
TAAR1 Q96RJ0 1/20 0.41
HIF1A Q16665 1/20 0.40
TP53 P04637 1/20 0.40
PYGL P06737 3/20 0.40
KMT2A Q03164 2/20 0.40
METAP2 P50579 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL5778185 0.82 MMP1 (0.34) HPGDALDH1A1KDM4E
SCHEMBL3529974 0.81 HPGD (0.67) HPGDCNR1ALDH1A1PLAAT3PLAAT5
SCHEMBL28753564 0.80 HPGD (0.50) HPGDCNR1ALDH1A1PLAAT3PLAAT5
SCHEMBL5779953 0.79 LTA4H (0.34) ALDH1A1KDM4E
SCHEMBL27611366 0.78 HPGD (0.49) HPGDCNR1ALDH1A1PLAAT3PLAAT5
SCHEMBL23405003 0.77 ALDH1A1 (0.53) HPGDALDH1A1KDM4ETDP1
SCHEMBL14685938 0.75 ALDH1A1 (0.47) ALDH1A1PYGLKMT2AMEN1
SCHEMBL5110287 0.75 P2RX7 (0.46) HPGDCNR1ALDH1A1PLAAT3PLAAT5
SCHEMBL1935713 0.74 MMP1 (0.46) HPGDALDH1A1PLAAT3PLAAT5PLAAT2
SCHEMBL27958719 0.74 ALDH1A1 (0.53) HPGDALDH1A1KDM4ETDP1

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-1612204-A1 HYDRAZONE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-01-04 EP disclosed