SCHEMBL26697204

SCHEMBL26697204

Cc1ccc(S(=O)OS(=O)c2ccccc2)cc1.[NaH].[NaH]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 0.44
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ LMNA P02545 3/20 0.40
▸ ACHE P22303 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ CES2 O00748 1/20 0.38
▸ CES1 P23141 1/20 0.38
▸ HPGD P15428 2/20 0.37
▸ TDP1 Q9NUW8 3/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ NPC1 O15118 2/20 0.36

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
SCHEMBL26907255 1.00 RECQL (0.44) RECQLCYP1A2CYP2C19ALDH1A1CYP3A4
SCHEMBL10886210 0.89 RECQL (0.50) RECQLCYP1A2CYP2C19ALDH1A1CYP3A4
SCHEMBL5702430 0.87 EPHX1 (0.35) LMNATSHRHPGD
SCHEMBL7553993 0.84 EPHX1 (0.34) LMNATSHRHPGD
SCHEMBL3088326 0.84 EPHX1 (0.37) ALDH1A1LMNATSHRHPGDTDP1
SCHEMBL28928747 0.78 HTT (0.42) RECQLCYP1A2CYP2C19ALDH1A1CYP3A4
SCHEMBL10872948 0.75 CYP1A2 (0.40) RECQLCYP1A2CYP2C19ALDH1A1CYP3A4
SCHEMBL17024044 0.74 RECQL (0.44) RECQLCYP1A2CYP2C19ALDH1A1CYP3A4
SCHEMBL7717102 0.73 ALDH1A1 (0.46) RECQLCYP1A2CYP2C19ALDH1A1CYP3A4
SCHEMBL12238362 0.73 ALDH1A1 (0.46) RECQLCYP1A2CYP2C19ALDH1A1CYP3A4

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-20230381066-A1 DENTAL CURABLE COMPOSITION HAVING GOOD COLOR COMPATIBILITY KURARAY NORITAKE DENTAL INC. (JP) 2023-11-30 — — US disclosed
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