SCHEMBL25657095

SCHEMBL25657095

C/C=C\C(=N/CC)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.44
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ CES2 O00748 2/20 0.34
▸ CES1 P23141 2/20 0.34
▸ PTGS2 P35354 3/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ PGR P06401 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ ADRA2B P18089 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HRH1 P35367 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ CYP3A4 P08684 3/20 0.33
▸ LMNA P02545 3/20 0.33
▸ AKT1 P31749 1/20 0.33
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ L3MBTL1 Q9Y468 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
SCHEMBL19853768 0.78 ATM (0.41) ATMCYP1A2CYP2D6HSD17B10CES2
SCHEMBL20674777 0.78 AKT1 (0.42) ATMCYP1A2CYP2D6HSD17B10CES2
SCHEMBL5032771 0.78 NFE2L2 (0.45) ATMCYP1A2CYP2D6HSD17B10CES2
SCHEMBL19685232 0.74 ATM (0.36) ATMCES2CES1CYP3A4LMNA
SCHEMBL19085495 0.73 AKT1 (0.36) ATMAKT1EGFRRECQL
SCHEMBL18105407 0.73 ATM (0.35) ATMEGFRRECQL
SCHEMBL21920995 0.73 CYP2C9 (0.45) CYP1A2CYP2D6HSD17B10CES2CES1
SCHEMBL18059364 0.70 F2 (0.42) ATMCYP1A2HSD17B10CYP3A4L3MBTL1
SCHEMBL12463754 0.70 ATM (0.33) ATMNPSR1LMNAAKT1EGFR
SCHEMBL6377003 0.70 ATM (0.48) ATMCYP1A2CYP2D6HSD17B10CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230200102-A1 MIXED LAYER, METHOD OF PREPARING THE MIXED LAYER, LIGHT-EMITTING DEVICE, AND ELECTRONIC APPARATUS SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 — — US disclosed
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