SCHEMBL10551027

SCHEMBL10551027

Cc1cc(NS(=O)(=O)NC(=O)N2C[C@H](NC(=O)Cc3csc(N)n3)C2=O)no1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ MAPT P10636 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ GABRA5 P31644 1/20 0.33
▸ GABRB2 P47870 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HPGD P15428 1/20 0.32
▸ GFER P55789 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL10413407 0.87 HSD17B10 (0.33) KDM4EALDH1A1L3MBTL1HSD17B10MAPT
SCHEMBL10549582 0.82 POLB (0.53) KDM4EALDH1A1L3MBTL1POLBHSD17B10
SCHEMBL10547616 0.81 GAPDH (0.40) KDM4EALDH1A1KMT2AHPGD
SCHEMBL10548246 0.80 GAPDH (0.40) KDM4EALDH1A1KMT2AHPGD
SCHEMBL10547546 0.80 NR1I2 (0.45) KDM4EALDH1A1L3MBTL1POLBHSD17B10
SCHEMBL10544574 0.80 ALDH1A1 (0.37) KDM4EALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL10544583 0.80 ALDH1A1 (0.37) KDM4EALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL10550552 0.80 NPC1 (0.41) ALDH1A1L3MBTL1POLBHSD17B10MEN1
SCHEMBL10545935 0.78 — —
SCHEMBL10546722 0.78 ESR1 (0.40) KDM4EALDH1A1L3MBTL1HSD17B10MAPT

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-4831130-A β-lactam antibacterial agents HOFFMANN-LA ROCHE INC. (US) 1989-05-16 — — US disclosed
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