SCHEMBL16021965

SCHEMBL16021965

CC(c1ccccc1)c1ccc(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)c(C(C)c2ccccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.36
KMT2A Q03164 3/20 0.36
TYR P14679 1/20 0.36
PTK2B Q14289 1/20 0.36
ADRB2 P07550 3/20 0.36
ADRB1 P08588 3/20 0.36
HTR1A P08908 1/20 0.36
KDM4E B2RXH2 4/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
HTT P42858 1/20 0.35
MEN1 O00255 2/20 0.35
ABCB11 O95342 1/20 0.34
CHRM2 P08172 1/20 0.34
ADRA2A P08913 1/20 0.34
DRD2 P14416 1/20 0.34
ADRA2B P18089 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
SCHEMBL14408937 0.92 ALDH1A1 (0.40) ALDH1A1KMT2ATYRADRB2KDM4E
SCHEMBL20090508 0.88 ALDH1A1 (0.39) ALDH1A1KMT2ATYRPTK2BADRB2
SCHEMBL19760409 0.84 TYR (0.38) ALDH1A1KMT2ATYRHTR1ALMNA
SCHEMBL15501165 0.82 CALM1 (0.39) ALDH1A1KMT2ATYRADRB1KDM4E
SCHEMBL20090507 0.81 MAPK1 (0.41) ALDH1A1KMT2ATYRKDM4ELMNA
SCHEMBL28815995 0.80 ALDH1A1 (0.50) ALDH1A1KMT2AKDM4ELMNASMN1; SMN2
SCHEMBL15501171 0.78 KDM4E (0.46) ALDH1A1HTR1AKDM4ELMNASMN1; SMN2
SCHEMBL13875587 0.78 ALDH1A1 (0.43) ALDH1A1KMT2AKDM4ELMNASMN1; SMN2
SCHEMBL11329638 0.77 ALDH1A1 (0.48) ALDH1A1KMT2ATYRADRB2KDM4E
SCHEMBL6696305 0.75 TYR (0.37) KMT2ATYRKDM4ELMNAMEN1

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
US-9186878-B2 Process for making lithographic printing plate FUJIFILM CORPORATION (JP) 2015-11-17 US disclosed
US-20140251172-A1 PROCESS FOR MAKING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2014-09-11 US disclosed