SCHEMBL30204309

SCHEMBL30204309

CN(C)c1cccc2c(S(=O)(=O)N3C[C@H](O)CC[C@H]3C(=O)O)cccc12

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.50
ATM Q13315 1/20 0.50
CA2 P00918 1/20 0.44
F2 P00734 1/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
HTR6 P50406 1/20 0.41
TGM2 P21980 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 1/20 0.41
HIF1A Q16665 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL26204959 1.00 KMT2A (0.50) KMT2AATMCA2F2PRSS1
SCHEMBL16669181 1.00 KMT2A (0.50) KMT2AATMCA2F2PRSS1
SCHEMBL30203859 1.00 KMT2A (0.50) KMT2AATMCA2F2PRSS1
SCHEMBL16669303 1.00 KMT2A (0.50) KMT2AATMCA2F2PRSS1
SCHEMBL26204953 1.00 KMT2A (0.50) KMT2AATMCA2F2PRSS1
SCHEMBL4126919 0.90 KMT2A (0.51) KMT2AATMCA2F2PRSS1
SCHEMBL5743956 0.85 KMT2A (0.60) KMT2AATMHTT
SCHEMBL31363195 0.85 KMT2A (0.60) KMT2AATMHTT
SCHEMBL5743967 0.85 KMT2A (0.60) KMT2AATMHTT
SCHEMBL30203995 0.84 KMT2A (0.62) KMT2AATMHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250179542-A1 BIOCATALYSTS AND METHODS FOR HYDROXYLATION OF CHEMICAL COMPOUNDS CODEXIS INC (US) 2025-06-05 US disclosed
US-12286648-B2 Engineered proline hydroxylase biocatalysts for hydroxylation of chemical compounds CODEXIS, INC. (US) 2025-04-29 US disclosed
US-12247234-B2 Biocatalysts and methods for hydroxylation of chemical compounds CODEXIS, INC. (US) 2025-03-11 US disclosed
US-20230272354-A1 BIOCATALYSTS AND METHODS FOR HYDROXYLATION OF CHEMICAL COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2023-08-31 US disclosed
US-20230227875-A1 BIOCATALYSTS AND METHODS FOR HYDROXYLATION OF CHEMICAL COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2023-07-20 US disclosed
US-11634695-B2 Vectors for expression of biocatalysts CODEXIS, INC. (US) 2023-04-25 US disclosed
US-11549132-B2 Biocatalysts and methods for hydroxylation of chemical compounds CODEXIS, INC. (US) 2023-01-10 US disclosed