SCHEMBL25256586

SCHEMBL25256586

CC(NC(=O)O)[C@@H](c1ccccc1)S(N)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.44
▸ KDM4E B2RXH2 4/20 0.44
▸ HPGD P15428 4/20 0.44
▸ LMNA P02545 3/20 0.44
▸ HSD17B10 Q99714 3/20 0.44
▸ KMT2A Q03164 2/20 0.42
▸ GMNN O75496 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PMP22 Q01453 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ EPHX2 P34913 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL25250588 0.83 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDLMNAHSD17B10
SCHEMBL28458253 0.77 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDLMNAKMT2A
SCHEMBL10317449 0.75 CA1 (0.46) LMNAHSD17B10KMT2APOLBMAPT
SCHEMBL16857532 0.75 DPP4 (0.48) ALDH1A1KDM4ELMNAHSD17B10KMT2A
SCHEMBL16165038 0.75 DPP4 (0.48) ALDH1A1KDM4ELMNAHSD17B10KMT2A
SCHEMBL16857380 0.75 DPP4 (0.48) ALDH1A1KDM4ELMNAHSD17B10KMT2A
SCHEMBL2552767 0.75 DPP4 (0.48) ALDH1A1KDM4ELMNAHSD17B10KMT2A
SCHEMBL16165039 0.75 DPP4 (0.48) ALDH1A1KDM4ELMNAHSD17B10KMT2A
SCHEMBL28358683 0.74 RECQL (0.46) ALDH1A1KDM4EHPGDLMNAHSD17B10
SCHEMBL2672977 0.74 HSD17B10 (0.63) ALDH1A1KDM4EHPGDLMNAHSD17B10

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
EP-4208452-A1 QUINOLINE CGAS ANTAGONIST COMPOUNDS Immunesensor Therapeutics, Inc. (US) 2023-07-12 — — EP disclosed
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