SCHEMBL29233308

SCHEMBL29233308

CNc1c(N)cnc2c(OC(F)(F)F)cccc12

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.39
LITAF Q99732 1/20 0.39
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
MPL P40238 1/20 0.36
GPR84 Q9NQS5 1/20 0.33
EPHX2 P34913 1/20 0.33
EGFR P00533 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
SCHEMBL29233306 0.80 PIN1 (0.40) TNFLITAF
SCHEMBL437559 0.73 HAVCR2 (0.40) TNFLITAFADORA2AADORA1ALOX5AP
SCHEMBL437620 0.73 ALOX5AP (0.38) TNFLITAFADORA2AADORA1ALOX5AP
SCHEMBL29828879 0.72 PI4KA (0.42) TNFLITAFADORA2AADORA1ALOX5AP
SCHEMBL8133730 0.69 ATP4A (0.48)
SCHEMBL31179075 0.68 HSP90AA1 (0.51) ADORA2AADORA1
SCHEMBL437125 0.68 NR4A2 (0.55) ADORA2AADORA1MPL
SCHEMBL30242047 0.68 TNF (0.45) TNFLITAF
SCHEMBL9212223 0.66 LRRK2 (0.46)
SCHEMBL23497102 0.66 PDE4A (0.42) TNFLITAFADORA2AADORA1EPHX2

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-112867714-B Pesticidal tricyclic compounds 巴斯夫欧洲公司 2024-06-11 CN disclosed
EP-4136086-A1 TRICYCLIC PESTICIDAL COMPOUNDS BASF SE (DE) 2023-02-22 EP disclosed
CN-115427408-A Pesticidal tricyclic compounds 巴斯夫欧洲公司 2022-12-02 CN disclosed
CN-112867714-A Pesticidal tricyclic compounds 巴斯夫欧洲公司 2021-05-28 CN disclosed