SCHEMBL8908795

SCHEMBL8908795

CCCCCCCCCCC(=O)Oc1ccc(C(=O)O)c(-c2ccc(C(=O)O[C@H](C)CCCCCCCC)c(F)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
RARB P10826 4/20 0.43
RARA P10276 3/20 0.43
RARG P13631 2/20 0.43
MCL1 Q07820 1/20 0.41
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
RECQL P46063 1/20 0.36
ALOX15 P16050 1/20 0.36
PTPN11 Q06124 4/20 0.36
LTB4R2 Q9NPC1 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 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
SCHEMBL9239152 0.95 ALDH1A1 (0.46) ALDH1A1RARBRARARARGMCL1
SCHEMBL7760864 0.90 RARB (0.45) RARBRARARARGMCL1KMT2A
SCHEMBL8611832 0.88 ALDH1A1 (0.53) ALDH1A1RARBRARARARGMCL1
SCHEMBL8200970 0.88 ALDH1A1 (0.50) ALDH1A1RARBKMT2AKDM4EMEN1
SCHEMBL8201147 0.88 ALDH1A1 (0.50) ALDH1A1RARBKMT2AKDM4EMEN1
SCHEMBL8190260 0.88 ALDH1A1 (0.50) ALDH1A1RARBKMT2AKDM4EMEN1
SCHEMBL8197823 0.88 ALDH1A1 (0.50) ALDH1A1RARBKMT2AKDM4EMEN1
SCHEMBL8213916 0.88 ALDH1A1 (0.50) ALDH1A1RARBKMT2AKDM4EMEN1
SCHEMBL8197939 0.88 ALDH1A1 (0.50) ALDH1A1RARBKMT2AKDM4EMEN1
SCHEMBL8196397 0.86 ALDH1A1 (0.47) ALDH1A1RARBKMT2AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5660762-A HIGH DISPLAY QUALITY IN BROAD TEMPERATURE RANGE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1997-08-26 US disclosed