SCHEMBL29639033

SCHEMBL29639033

CCc1cc(N)c(N)cc1CC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.44
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
POLB P06746 2/20 0.41
HTT P42858 2/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
ALDH1A1 P00352 4/20 0.39
MAPT P10636 2/20 0.39
ALOX15 P16050 3/20 0.37
ALOX12 P18054 1/20 0.37
AR P10275 1/20 0.36
CYP1A2 P05177 1/20 0.36
CASP7 P55210 1/20 0.36

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
SCHEMBL5951845 1.00 PTK2 (0.44) PTK2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL11468902 0.88 AR (0.42) PTK2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL832574 0.87 ALDH1A1 (0.43) PTK2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL13375163 0.87 GRIA1 (0.38) PTK2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3107558 0.85 GRIN2D (0.37) PTK2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5951712 0.83 ALDH1A1 (0.52) PTK2POLBHTTNOS3NOS1
SCHEMBL13375174 0.83 POLB (0.36) PTK2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5382583 0.81 AR (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8729779 0.81 ALDH1A1 (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10545243 0.81 POLB (0.38) PTK2GRIN2DGRIN3BGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119547016-A Positive photosensitive composition, cured film, organic EL display device, and pigment 东丽株式会社 2025-02-28 CN disclosed
CN-117043676-A Positive photosensitive pigment composition, cured film containing cured product thereof, and organic EL display device 东丽株式会社 2023-11-10 CN disclosed
CN-113087674-B Method for synthesizing quinoxaline compound under catalysis of visible light induced photosensitizer 河南大学 2022-06-17 CN disclosed