SCHEMBL6562354

SCHEMBL6562354

CCCc1ccc(-c2ccc(C(=O)O)cc2)c(-c2ccc(C(=O)O[C@H](C)CC(CC)CC)c(F)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.41
RARA P10276 3/20 0.39
RARG P13631 1/20 0.39
FOLH1 Q04609 1/20 0.37
MPL P40238 2/20 0.36
NPC1 O15118 1/20 0.36
TP53 P04637 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
PTPN11 Q06124 1/20 0.35
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34
FEN1 P39748 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
MTOR P42345 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL6547940 0.89 HCRTR1 (0.39) RARBRARAFOLH1HCRTR1HCRTR2
SCHEMBL6564029 0.88 NPC1 (0.41) RARBRARAFOLH1MPLNPC1
SCHEMBL6937388 0.82 PTPN11 (0.52) RARBRARATP53PTPN11
SCHEMBL7604365 0.80 PTPN11 (0.42) RARBRARARARGNPC1TP53
SCHEMBL6562349 0.79 MAPT (0.42) RARBRARARARGNPC1RAB9A
SCHEMBL6547284 0.78 MAPT (0.44) RARBFOLH1HCRTR1HCRTR2PTPN11
SCHEMBL7526394 0.77 PDCD1 (0.38) RARBNPC1SMN1; SMN2HCRTR1HCRTR2
SCHEMBL9626753 0.76 PTPN11 (0.58) RARBRARATP53PTPN11
SCHEMBL6547277 0.76 MAPT (0.42) RARBFOLH1HCRTR1HCRTR2PTPN11
SCHEMBL8015669 0.76 RARB (0.54) RARBRARARARGFOLH1MPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1225212-B1 Optically active compound and liquid crystal composition containing the compound MITSUBISHI GAS CHEMICAL CO (JP) 2004-03-24 EP disclosed
US-6677475-B2 FOR USE IN LIQUID CRYSTAL DISPLAY DEVICE MITSUBISHI GAS CHEMICAL CO., INC. (JP) 2004-01-13 US disclosed
EP-1225212-A1 Optically active compound and liquid crystal composition containing the compound MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2002-07-24 EP disclosed