SCHEMBL2804918

SCHEMBL2804918

Cc1ccc2c(c1OCCO)-c1ccccc1C2c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 2/20 0.38
ALDH1A1 P00352 3/20 0.35
RECQL P46063 1/20 0.35
KDM4E B2RXH2 2/20 0.35
NR3C1 P04150 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
LMNA P02545 1/20 0.32
CD274 Q9NZQ7 3/20 0.31
SCN4A P35499 2/20 0.31
HTR7 P34969 1/20 0.31
PDCD1 Q15116 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL2804686 0.90 ALDH1A1 (0.39) SCN8AALDH1A1RECQLKDM4EL3MBTL1
SCHEMBL577259 0.77 SCN8A (0.36) SCN8AALDH1A1RECQLKDM4EL3MBTL1
SCHEMBL8416167 0.75 MYC (0.42) ALDH1A1NR3C1TP53MAPK1LMNA
SCHEMBL8681891 0.72 ALDH1A1 (0.41) ALDH1A1RECQLKDM4EL3MBTL1TP53
SCHEMBL28187238 0.72 ALDH1A1 (0.43) ALDH1A1NR3C1TP53MAPK1RAB9A
SCHEMBL30985950 0.70 ALDH1A1 (0.53) ALDH1A1RECQLTP53MAPK1RAB9A
SCHEMBL577071 0.70 ALDH1A1 (0.53) ALDH1A1RECQLTP53MAPK1RAB9A
SCHEMBL8681675 0.69 ALDH1A1 (0.34) ALDH1A1RECQLKDM4ETP53MAPK1
SCHEMBL577512 0.69 L3MBTL1 (0.39) ALDH1A1KDM4EL3MBTL1TP53MAPK1
SCHEMBL8686776 0.68 GLRA1 (0.36) ALDH1A1RECQLKDM4ETP53MAPK1

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
EP-2180014-B1 Method for producing thermoplastic resin, polyester resin and polycarbonate resin, and their applications MITSUBISHI GAS CHEMICAL CO (JP) 2011-12-14 EP disclosed
EP-2180014-A1 Method for producing thermoplastic resin, polyester resin and polycarbonate resin, and their applications MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-04-28 EP disclosed