SCHEMBL22472307

SCHEMBL22472307

CCCO[Si](CCCn1c(=O)[nH]c(=O)[nH]c1=O)(OCCC)OCCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 5/20 0.38
PDE4A P27815 3/20 0.38
ADORA2A P29274 3/20 0.38
PDE4B Q07343 3/20 0.38
PDE4C Q08493 3/20 0.38
PDE4D Q08499 3/20 0.38
ADORA3 P0DMS8 3/20 0.38
MAPT P10636 2/20 0.35
ATM Q13315 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
ALDH1A1 P00352 3/20 0.34
USP2 O75604 3/20 0.34
POLB P06746 3/20 0.34
KEAP1 Q14145 2/20 0.34
NFE2L2 Q16236 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
RGS12 O14924 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL22472338 0.92 ADORA2B (0.40) ADORA2BPDE4AADORA2APDE4BPDE4C
SCHEMBL4129111 0.87 ADORA2B (0.36) ADORA2BPDE4AADORA2APDE4BPDE4C
SCHEMBL29283325 0.86 ADORA2B (0.37) ADORA2BPDE4AADORA2APDE4BPDE4C
SCHEMBL2500685 0.82 ADORA2A (0.35) ADORA2BPDE4AADORA2APDE4BPDE4C
SCHEMBL557549 0.80 ADORA2B (0.35) ADORA2BPDE4AADORA2APDE4BPDE4C
SCHEMBL29283309 0.79 PDE4A (0.31) ADORA2BPDE4AADORA2APDE4BPDE4C
SCHEMBL29283316 0.78 ADORA2B (0.40) ADORA2BPDE4AADORA2APDE4BPDE4C
SCHEMBL8041944 0.77 MEN1 (0.32) ADORA2BPDE4AADORA2APDE4BPDE4C
SCHEMBL9681087 0.76 ADORA2B (0.35) ADORA2BPDE4AADORA2APDE4BPDE4C
SCHEMBL4141489 0.76 PDE4A (0.33) ADORA2BPDE4AADORA2APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118103465-A Coating composition, coated article, and method for forming cured film 信越化学工业株式会社 2024-05-28 CN disclosed
CN-113748134-B Conjugated diene copolymer and method for producing conjugated diene copolymer 瑞住合成橡胶株式会社 2024-03-08 CN disclosed
CN-110461893-B Conjugated diene polymer and method for producing conjugated diene polymer 住友化学株式会社 2023-10-27 CN disclosed
CN-109563186-B Method for producing modified conjugated diene polymer and method for producing polymer composition 住友化学株式会社 2022-04-15 CN disclosed
CN-113748134-A Conjugated diene copolymer and method for producing conjugated diene copolymer 瑞住合成橡胶株式会社 2021-12-03 CN disclosed
WO-2020196886-A1 CONJUGATED DIENE COPOLYMER AND METHOD FOR MANUFACTURING CONJUGATED DIENE COPOLYMER ZSエラストマー株式会社 2020-10-01 WO disclosed