SCHEMBL18062192

SCHEMBL18062192

CC1=C(C)C(c2ccccc2[N+](=O)[O-])C(COC=O)=C(C)N1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1D Q01668 5/20 0.51
CACNA1C Q13936 4/20 0.51
ADORA3 P0DMS8 3/20 0.51
CACNA1F O60840 3/20 0.51
CACNA1S Q13698 3/20 0.51
KMT2A Q03164 3/20 0.51
ABCC4 O15439 2/20 0.51
ABCB11 O95342 2/20 0.51
LMNA P02545 2/20 0.51
CYP1A2 P05177 2/20 0.51
ADORA2A P29274 2/20 0.51
ADORA1 P30542 2/20 0.51
OPRM1 P35372 2/20 0.51
SCN1A P35498 2/20 0.51
HTR2B P41595 2/20 0.51
KCNH2 Q12809 2/20 0.51
SCN5A Q14524 2/20 0.51
SCN2A Q99250 2/20 0.51
SCN3A Q9NY46 2/20 0.51
CACNA1B Q00975 2/20 0.51

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
SCHEMBL13819620 0.85 ADORA3 (0.72) CACNA1DCACNA1CADORA3CACNA1FCACNA1S
SCHEMBL6859870 0.81 CACNA1D (0.71) CACNA1DCACNA1CADORA3CACNA1FCACNA1S
SCHEMBL13198586 0.81 CACNA1C (0.63) CACNA1DCACNA1CADORA3CACNA1FCACNA1S
SCHEMBL14535054 0.78 ADORA3 (0.62) CACNA1DCACNA1CADORA3CACNA1FCACNA1S
SCHEMBL16203201 0.78 CACNA1C (0.54) CACNA1DCACNA1CADORA3CACNA1FCACNA1S
SCHEMBL7270491 0.76 CACNA1D (0.59) CACNA1DCACNA1CADORA3CACNA1FCACNA1S
SCHEMBL12727534 0.73 CACNA1C (0.58) CACNA1DCACNA1CADORA3CACNA1FCACNA1S
SCHEMBL16087942 0.72 CACNA1D (0.48) CACNA1DCACNA1CADORA3CACNA1FCACNA1S
SCHEMBL8711835 0.72 CACNA1D (0.60) CACNA1DCACNA1CADORA3CACNA1FCACNA1S
SCHEMBL14331445 0.71 ADORA3 (0.66) CACNA1DCACNA1CADORA3CACNA1FCACNA1S

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
US-9709710-B2 Device including light blocking layer and method of patterning the light blocking layer SAMSUNG SDI CO., LTD. (KR) 2017-07-18 US disclosed
US-20160259095-A1 Device Including Light Blocking Layer and Method of Patterning the Light Blocking Layer SAMSUNG SDI CO., LTD. (KR) 2016-09-08 US disclosed