SCHEMBL6690262

SCHEMBL6690262

CCC(O)C(O)Oc1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.44
KDM4E B2RXH2 4/20 0.40
TDP1 Q9NUW8 3/20 0.40
MAPK1 P28482 3/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 4/20 0.38
SLC6A4 P31645 1/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
GAA P10253 2/20 0.36
LMNA P02545 2/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL6661078 1.00 LDHA (0.44) LDHAKDM4ETDP1MAPK1MEN1
SCHEMBL6662309 1.00 LDHA (0.44) LDHAKDM4ETDP1MAPK1MEN1
SCHEMBL6657147 0.81 SLC6A4 (0.37) SMN1; SMN2SLC6A4
SCHEMBL28583037 0.80 TRPA1 (0.46) ALDH1A1MAPTSLC6A4PPARGPPARA
SCHEMBL6659807 0.76 SLC6A4 (0.45) SMN1; SMN2SLC6A4PPARGPPARAHPGD
SCHEMBL12953262 0.75 LDHA (0.45) LDHAKDM4ETDP1MAPK1MEN1
SCHEMBL9966866 0.74 LDHA (0.44) LDHAKDM4ETDP1MEN1KMT2A
SCHEMBL28334987 0.74 LDHA (0.44) LDHAKDM4ETDP1MEN1KMT2A
SCHEMBL7966339 0.73 LDHA (0.44) LDHAKDM4ETDP1MAPK1MEN1
SCHEMBL6661442 0.73 KDM4E (0.41) LDHAKDM4ETDP1MAPK1ALDH1A1

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-1160233-B1 Novel terphenyl compounds SHARP KK (JP) 2004-07-21 EP disclosed
EP-1160233-A2 Novel terphenyl compounds SHARP KABUSHIKI KAISHA (JP) 2001-12-05 EP disclosed