SCHEMBL8201020

SCHEMBL8201020

CCCCCCCCCCC(=O)Oc1ccc(C(=O)O)c(F)c1-c1ccc(C(=O)O[C@H](C)CCCCCCCC)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
RARB P10826 3/20 0.43
RARA P10276 2/20 0.43
RARG P13631 1/20 0.43
PPARD Q03181 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
POLM Q9NP87 1/20 0.37
POLK Q9UBT6 1/20 0.37
POLL Q9UGP5 1/20 0.37
POLH Q9Y253 1/20 0.37
PTPN11 Q06124 4/20 0.35
TOP2A P11388 2/20 0.35
MGLL Q99685 3/20 0.34
PTPN1 P18031 1/20 0.34
PTPN6 P29350 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
SCHEMBL8203150 0.93 ALDH1A1 (0.50) ALDH1A1RARBRARARARGPPARD
SCHEMBL8201144 0.89 ALDH1A1 (0.49) ALDH1A1RARBRARARARGPPARD
SCHEMBL8189184 0.89 ALDH1A1 (0.49) ALDH1A1RARBRARARARGPPARD
SCHEMBL8198668 0.89 ALDH1A1 (0.49) ALDH1A1RARBRARARARGPPARD
SCHEMBL8201218 0.89 ALDH1A1 (0.49) ALDH1A1RARBRARARARGPPARD
SCHEMBL8197509 0.89 ALDH1A1 (0.49) ALDH1A1RARBRARARARGPPARD
SCHEMBL8197563 0.87 ALDH1A1 (0.47) ALDH1A1RARBRARARARGPPARD
SCHEMBL8197722 0.84 ALDH1A1 (0.46) ALDH1A1RARBRARARARGPPARD
SCHEMBL8908795 0.84 ALDH1A1 (0.50) ALDH1A1RARBRARARARGKDM4E
SCHEMBL8198694 0.81 ALDH1A1 (0.49) ALDH1A1RARBRARARARGKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0718274-B1 Two-rings-containing phenyl ester compound and anti-ferroelectric liquid crystal composition containing the same MITSUBISHI GAS CHEMICAL CO (JP) 2000-02-09 EP disclosed
US-6018070-A WHEN INCORPORATED AS A COMPONENT FOR AN ANTIFERROELECTRIC LIQUID CRYSTAL COMPOSITION THE NOVEL TWO-RING-CONTAINING COMPOUND INCREASES THE RESPONSE SPEED OF THE COMPOSITION IN A BROAD TEMPERATURE RANGE MITSUBISHI GAS CHEMICALS COMPANY, INC. (JP) 2000-01-25 US disclosed
US-5660762-A HIGH DISPLAY QUALITY IN BROAD TEMPERATURE RANGE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1997-08-26 US disclosed
EP-0718274-A1 Two-rings-containing phenyl ester compound and anti-ferroelectric liquid crystal composition containing the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1996-06-26 EP disclosed