SCHEMBL30856498

SCHEMBL30856498

NCc1ccccc1OC1CC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 9/20 0.50
PRMT1 Q99873 9/20 0.50
HRH1 P35367 5/20 0.50
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KCNH2 Q12809 1/20 0.44
CSNK2A1 P68400 2/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
PNMT P11086 1/20 0.39

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
SCHEMBL23761234 1.00 CARM1 (0.50) CARM1PRMT1HRH1SLC6A2SLC6A4
SCHEMBL29786357 0.92 CARM1 (0.58) CARM1PRMT1HRH1SLC6A2SLC6A4
SCHEMBL6492804 0.92 CARM1 (0.58) CARM1PRMT1HRH1SLC6A2SLC6A4
SCHEMBL23004969 0.92 CARM1 (0.55) CARM1PRMT1HRH1SLC6A2SLC6A4
SCHEMBL29786600 0.91 CARM1 (0.61) CARM1PRMT1HRH1SLC6A2SLC6A4
SCHEMBL20472407 0.91 CARM1 (0.61) CARM1PRMT1HRH1SLC6A2SLC6A4
SCHEMBL16814992 0.88 KAT2B (0.49) CARM1PRMT1HRH1SLC6A2SLC6A4
SCHEMBL29786402 0.88 KAT2B (0.49) CARM1PRMT1HRH1SLC6A2SLC6A4
SCHEMBL3289933 0.85 HRH1 (0.57) CARM1PRMT1HRH1SLC6A2SLC6A3
SCHEMBL29786608 0.85 MCHR1 (0.50) CARM1PRMT1HRH1SLC6A2SLC6A4

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
CN-115667236-B 1, 5-Dihydro-2, 4-benzodiazepine-3-one derivative and application thereof 江苏恩华药业股份有限公司 2024-04-26 CN disclosed