SCHEMBL29941502

SCHEMBL29941502

O=S(=O)(O)c1cc2ncccc2s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
NAMPT P43490 1/20 0.41
GRIN3B O60391 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2C Q14957 1/20 0.40
F10 P00742 5/20 0.38
PLAT P00750 2/20 0.38
PROC P04070 2/20 0.38
PRSS1 P07477 2/20 0.38
F2 P00734 1/20 0.37
PLG P00747 1/20 0.37
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
CA2 P00918 3/20 0.36
PSMB8 P28062 1/20 0.35
PSMB5 P28074 1/20 0.35
COMT P21964 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.35
NAPRT Q6XQN6 1/20 0.34
KDM4E B2RXH2 2/20 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
SCHEMBL6222812 1.00 ALOX5 (0.43) ALOX5NAMPTGRIN3BGRIN1GRIN2C
SCHEMBL2916499 0.83 CA2 (0.54) ALOX5NAMPTGRIN3BGRIN1GRIN2C
SCHEMBL6221023 0.83 ALOX5 (0.40) ALOX5NAMPTGRIN3BGRIN1GRIN2C
SCHEMBL8128914 0.79 POLB (0.41) ALOX5NAMPTGRIN3BGRIN1GRIN2C
SCHEMBL6219931 0.72 CYP2A6 (0.51) NAMPTF10PRSS1CA2COMT
SCHEMBL4710724 0.72 ALOX5 (0.44) ALOX5NAMPTGRIN3BGRIN1GRIN2C
SCHEMBL5262440 0.71 AKR1B1 (0.67)
SCHEMBL28017683 0.71 ALOX5 (0.43) ALOX5NAMPTGRIN3BGRIN1GRIN2C
SCHEMBL4474940 0.71 F10 (0.40) F10PLATPROCPRSS1F2
SCHEMBL329450 0.71 CA2 (0.67) CA2LOXL2CA12CA1CA4

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
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed