SCHEMBL28655249

SCHEMBL28655249

COCC(OC)(OC)c1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
AHR P35869 2/20 0.40
CHRM2 P08172 1/20 0.40
BLM P54132 2/20 0.34
CYP2D6 P10635 1/20 0.34
HDAC6 Q9UBN7 3/20 0.33
POLB P06746 2/20 0.33
KDM4E B2RXH2 2/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CCR1 P32246 1/20 0.33
CCR5 P51681 1/20 0.33
CCR8 P51685 1/20 0.33
METAP1 P53582 1/20 0.33
HIF1A Q16665 1/20 0.33
DOHH Q9BU89 1/20 0.33
P4HTM Q9NXG6 1/20 0.33
GAA P10253 1/20 0.33
CHRM3 P20309 1/20 0.32

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
SCHEMBL10513935 0.83 L3MBTL1 (0.48) L3MBTL1SMN1; SMN2AHRCHRM2BLM
SCHEMBL6474016 0.83 SMN1; SMN2 (0.44) L3MBTL1SMN1; SMN2AHRCHRM2BLM
SCHEMBL7066946 0.76 SMN1; SMN2 (0.38) L3MBTL1SMN1; SMN2AHRCHRM2BLM
SCHEMBL17976467 0.75 SMN1; SMN2 (0.52) L3MBTL1SMN1; SMN2AHRCHRM2BLM
Ammonia Solution, Strong SCHEMBL27641252 0.74 SMN1; SMN2 (0.50) L3MBTL1SMN1; SMN2AHRCHRM2BLM
SCHEMBL12934595 0.74 SMN1; SMN2 (0.50) L3MBTL1SMN1; SMN2AHRCHRM2BLM
SCHEMBL5148545 0.74 SMN1; SMN2 (0.50) L3MBTL1SMN1; SMN2AHRCHRM2BLM
SCHEMBL21742264 0.73 SMN1; SMN2 (0.45) L3MBTL1SMN1; SMN2AHRCHRM2BLM
SCHEMBL21742014 0.72 SMN1; SMN2 (0.44) L3MBTL1SMN1; SMN2AHRCHRM2BLM
SCHEMBL6293779 0.71 KCNN4 (0.42) KDM4ELMNAGAA

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
CN-113736307-B Hole transporting ink composition, light emitting device, and method of manufacturing light emitting device 三星显示有限公司 2024-04-09 CN disclosed
CN-113736307-A Hole-transporting ink composition, light-emitting device, and method for producing light-emitting device 三星显示有限公司 2021-12-03 CN disclosed