SCHEMBL7868837

SCHEMBL7868837

Cc1ccc(C(O)Cc2ccc(S(=O)(=O)CCC(=O)O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.51
▸ ALDH1A1 P00352 4/20 0.50
▸ HTT P42858 2/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ LMNA P02545 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ GAA P10253 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ APEX1 P27695 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ PAX8 Q06710 1/20 0.46

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
SCHEMBL7704838 0.84 ALDH1A1 (0.67) KMT2AALDH1A1HTTNPSR1LMNA
SCHEMBL7868867 0.82 ALDH1A1 (0.65) KMT2AALDH1A1HTTNPSR1LMNA
SCHEMBL7866978 0.77 KMT2A (0.60) KMT2AALDH1A1HTTNPSR1LMNA
SCHEMBL7862238 0.76 ALDH1A1 (0.56) KMT2AALDH1A1HTTNPSR1LMNA
SCHEMBL24785864 0.75 NR3C2 (0.46) ALDH1A1LMNAMAPT
SCHEMBL7868839 0.75 HTT (0.63) KMT2AALDH1A1HTTNPSR1LMNA
SCHEMBL19066564 0.75 ALDH1A1 (0.69) KMT2AALDH1A1HTTNPSR1LMNA
SCHEMBL7862237 0.74 KMT2A (0.57) KMT2AALDH1A1HTTNPSR1LMNA
SCHEMBL8448862 0.74 TDP1 (0.57) ALDH1A1HTTNPSR1KDM4EGAA
SCHEMBL5189622 0.73 ALDH1A1 (0.67) KMT2AALDH1A1HTTNPSR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6300514-B1 INHIBITING MATRIX METALLOPROTEINASES ONO PHARMACEUTICAL CO., LTD. (JP) 2001-10-09 — — US disclosed
EP-0994104-A1 ARYL (SULFIDE, SULFOXIDE AND SULFONE) DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2000-04-19 — — EP disclosed
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