SCHEMBL28015205

SCHEMBL28015205

O=C(OC1CCCC2CCCCC21)c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.46
GAA P10253 2/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 2/20 0.43
NR4A1 P22736 1/20 0.41
NR4A2 P43354 1/20 0.41
NR4A3 Q92570 1/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LGALS9 O00182 1/20 0.40
LGALS8 O00214 1/20 0.40
LGALS1 P09382 1/20 0.40
LGALS3 P17931 1/20 0.40
LGALS7; LGALS7B P47929 1/20 0.40
CNR2 P34972 3/20 0.39
CNR1 P21554 2/20 0.39
SIGMAR1 Q99720 1/20 0.39
MMP3 P08254 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
ADRB2 P07550 1/20 0.38

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
SCHEMBL2117154 0.80 KMT2A (0.53) BCHEGAAKMT2APOLBNR4A1
SCHEMBL27499333 0.80 KMT2A (0.53) BCHEGAAKMT2APOLBNR4A1
SCHEMBL27105760 0.80 LGALS9 (0.46) BCHEGAAKMT2APOLBNR4A1
SCHEMBL24278621 0.80 BCHE (0.46) BCHEGAAKMT2APOLBNR4A1
SCHEMBL24278714 0.80 LGALS9 (0.46) BCHEGAAKMT2APOLBNR4A1
SCHEMBL24278806 0.80 LGALS9 (0.46) BCHEGAAKMT2APOLBNR4A1
SCHEMBL25792918 0.80 LGALS9 (0.46) BCHEGAAKMT2APOLBNR4A1
SCHEMBL2119946 0.79 KMT2A (0.56) BCHEGAAKMT2APOLBNR4A1
SCHEMBL10963954 0.78 KDM4E (0.53) GAAKMT2AKDM4EALDH1A1LMNA
SCHEMBL27479917 0.77 KMT2A (0.54) BCHEGAAKMT2APOLBNR4A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108348906-A Hydrogenation catalyst composition and method for producing same, and hydrogenated polymer and method for producing same 旭化成株式会社 2018-07-31 CN disclosed
CN-104736574-B The manufacture method and hydrogenation catalyst composition of hydrogenation catalyst composition 旭化成株式会社 2017-08-08 CN disclosed
CN-104640629-B Catalyst composition for hydrogenation and hydrogenation method using catalyst composition for hydrogenation 旭化成株式会社 2017-05-24 CN disclosed
CN-104718026-B Hydrogenation catalyst composition and hydrogenation method using said hydrogenation catalyst composition 旭化成株式会社 2017-05-17 CN disclosed
CN-104736574-A Method of producing hydrogenation catalyst composition and hydrogenation catalyst composition ASAHI KASEI CHEMICALS CORP 2015-06-24 CN disclosed
CN-104718026-A Hydrogenation catalyst composition and hydrogenation method using said hydrogenation catalyst composition ASAHI KASEI CHEMICALS CORP 2015-06-17 CN disclosed
CN-104640629-A Catalyst composition for hydrogenation and hydrogenation method using catalyst composition for hydrogenation ASAHI KASEI CHEMICALS CORP 2015-05-20 CN disclosed