SCHEMBL28465622

SCHEMBL28465622

[CH](NC1CCCCCC1)NC1CCCCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 4/20 0.60
ADH1A P07327 4/20 0.60
ADH1C P00326 3/20 0.60
ADH4 P08319 1/20 0.60
ADH7 P40394 2/20 0.55
ALDH1A1 P00352 3/20 0.50
HSD17B10 Q99714 1/20 0.50
EPHX1 P07099 7/20 0.46
NPC1 O15118 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
RAB9A P51151 3/20 0.46
CYP3A4 P08684 2/20 0.46
KDM4E B2RXH2 1/20 0.46
EPHX2 P34913 1/20 0.46
CA1 P00915 2/20 0.39
CA12 O43570 1/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL15855910 0.75 ADH1B (0.55) ADH1BADH1AADH1CADH4ADH7
SCHEMBL624264 0.75
SCHEMBL245391 0.75 ADH1B (1.00) ADH1BADH1AADH1CADH4ADH7
Cyclohexylformamide SCHEMBL26146 0.75
SCHEMBL21693889 0.75
SCHEMBL22988657 0.75 ADH1B (1.00) ADH1BADH1AADH1CADH4ADH7
SCHEMBL1171679 0.75
SCHEMBL1485850 0.75 ADH1B (0.55) ADH1BADH1AADH1CADH4ADH7
SCHEMBL2112448 0.75 ADH1B (1.00) ADH1BADH1AADH1CADH4ADH7
SCHEMBL645299 0.75 ADH1B (1.00) ADH1BADH1AADH1CADH4ADH7

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
CN-110431696-B Binder composition for secondary battery 日本电气株式会社 2022-12-06 CN disclosed
CN-109563282-B Medical film and method for producing same, medical coating composition, medical device and method for producing same 三井化学株式会社 2022-04-15 CN disclosed
CN-107849352-B Polyimide precursor composition and polyimide composition 宇部兴产株式会社 2021-05-28 CN disclosed
CN-111868099-A Method for setting polymerization conditions and method for producing optical material 三井化学株式会社 2020-10-30 CN disclosed