SCHEMBL8769252

SCHEMBL8769252

CCCCCCCCCCCCCCc1cc(C(=O)O)ccc1-c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.60
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
RARA P10276 1/20 0.52
MAPT P10636 1/20 0.52
MTOR P42345 1/20 0.52
KMT2A Q03164 1/20 0.52
PTPN11 Q06124 2/20 0.51
BID P55957 3/20 0.50
MCL1 Q07820 3/20 0.50
BCL2L1 Q07817 2/20 0.50
BAK1 Q16611 2/20 0.50
KAT8 Q9H7Z6 2/20 0.50
PPARA Q07869 2/20 0.50
PPARG P37231 1/20 0.50
EP300 Q09472 1/20 0.50
KAT2A Q92830 1/20 0.50
KAT2B Q92831 1/20 0.50
KAT5 Q92993 1/20 0.50
SAE1 Q9UBE0 1/20 0.50

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
SCHEMBL8769281 1.00 RARB (0.60) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL7147421 1.00 RARB (0.60) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL10596391 1.00 RARB (0.60) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL8769316 1.00 RARB (0.60) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL15741313 0.94 RARB (0.52) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL29488620 0.94 RARB (0.52) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL29488619 0.94 RARB (0.52) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL7998574 0.90 RARB (0.59) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL8526681 0.89 RARB (0.61) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL9394701 0.89 RARB (0.61) RARBMEN1ALDH1A1RARAMAPT

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-0617109-B1 Liquid crystal material, liquid crystal composition and liquid crystal element MITSUI PETROCHEMICAL IND (JP) 1997-09-17 EP disclosed
US-5422039-A Having a chiral center-containing a tetralinylene ring as well as a second chiral center; cells having high temperature operating range; high switching speed, low voltage and stable contrast MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1995-06-06 US disclosed
EP-0617109-A1 Liquid crystal material, liquid crystal composition and liquid crystal element MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-09-28 EP disclosed