SCHEMBL28584348

SCHEMBL28584348

CN(C)c1cccc(S(N)(=O)=O)c1N=Nc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 11/20 0.53
▸ CA9 Q16790 10/20 0.46
▸ CA12 O43570 9/20 0.46
▸ HTR6 P50406 1/20 0.44
▸ MEN1 O00255 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ MAPK1 P28482 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ F2 P00734 3/20 0.40
▸ PRSS1 P07477 3/20 0.40
▸ PRSS2 P07478 3/20 0.40
▸ PRSS3 P35030 3/20 0.40
▸ CA1 P00915 5/20 0.38
▸ CA4 P22748 1/20 0.38

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
SCHEMBL28604415 0.85 POLB (0.46) CA2CA9CA12HTR6MEN1
SCHEMBL29469920 0.75 CA2 (0.67) CA2CA9CA12HTR6KMT2A
SCHEMBL2117356 0.75 CA2 (0.67) CA2CA9CA12HTR6KMT2A
SCHEMBL3720716 0.73 MYC (0.52) MEN1POLBKMT2ANPC1RAB9A
SCHEMBL133466 0.73 TDP1 (0.43) CA2CA9CA12HTR6MEN1
SCHEMBL8149846 0.73 CA2 (0.64) CA2CA9CA12HTR6KMT2A
SCHEMBL28584350 0.72 CA2 (0.54) CA2CA9CA12HTR6MEN1
SCHEMBL11146594 0.71 EDNRA (0.41) CA2MEN1POLBKMT2AF2
SCHEMBL10706740 0.71 SUMO2 (0.46) CA2CA9CA12MEN1POLB
SCHEMBL10706736 0.71 SUMO2 (0.46) CA2CA9CA12MEN1POLB

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-113115588-A Novel carbamate hydrolase for enzymatic decomposition of polyurethane 科思创知识产权两合公司 2021-07-13 — — CN disclosed
Send feedback