SCHEMBL7307327

SCHEMBL7307327

CCCC(=O)c1ccc([O])c2c(C(=O)CCC)cccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.43
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 4/20 0.43
HSD17B10 Q99714 4/20 0.43
POLB P06746 3/20 0.43
KMT2A Q03164 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
CYP1A2 P05177 3/20 0.43
LMNA P02545 3/20 0.43
TSHR P16473 3/20 0.43
CYP2D6 P10635 2/20 0.43
MEN1 O00255 2/20 0.43
GMNN O75496 2/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 2/20 0.43
BLM P54132 2/20 0.43
PMP22 Q01453 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
CMKLR1 Q99788 2/20 0.43
ALOX15 P16050 2/20 0.43

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
SCHEMBL7303953 0.82 HPGD (0.42) HPGDALDH1A1KDM4EHSD17B10POLB
SCHEMBL4104419 0.77 ALDH1A1 (0.43) HPGDALDH1A1KDM4EHSD17B10POLB
SCHEMBL27170475 0.75 ALDH1A1 (0.66) HPGDALDH1A1KDM4EHSD17B10POLB
SCHEMBL8579526 0.75 TCF4 (0.46) HPGDALDH1A1KDM4EHSD17B10POLB
SCHEMBL29875679 0.75 ALDH1A1 (0.70) HPGDALDH1A1KDM4EHSD17B10POLB
SCHEMBL1716864 0.75 ALDH1A1 (0.70) HPGDALDH1A1KDM4EHSD17B10POLB
SCHEMBL2123580 0.75 HPGD (0.73) HPGDALDH1A1KDM4EHSD17B10POLB
SCHEMBL8579525 0.74 LMNA (0.41) HPGDALDH1A1KDM4EHSD17B10POLB
SCHEMBL7303631 0.73 ALDH1A1 (0.40) HPGDALDH1A1KDM4EHSD17B10POLB
SCHEMBL13656741 0.73 GABRA1 (0.54) HPGDALDH1A1KDM4EHSD17B10POLB

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
US-5629406-A AMINO ACID DERIVATIVES SANKYO COMPANY, LIMITED (JP) 1997-05-13 US disclosed
EP-0587311-A1 Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1994-03-16 EP disclosed