SCHEMBL3258948

SCHEMBL3258948

CC(C(=O)O)c1cnc(NS(=O)(=O)c2ccc(F)cc2)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.45
▸ LMNA P02545 1/20 0.45
▸ MMP1 P03956 1/20 0.44
▸ MMP2 P08253 1/20 0.44
▸ MMP3 P08254 1/20 0.44
▸ MMP7 P09237 1/20 0.44
▸ MMP9 P14780 1/20 0.44
▸ MMP13 P45452 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ METAP2 P50579 1/20 0.41
▸ PIK3CA P42336 1/20 0.41
▸ MTOR P42345 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ CA1 P00915 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
SCHEMBL3255951 0.78 ADAMTS4 (0.45) LMNAMMP1MMP2MMP3MMP7
SCHEMBL3251733 0.75 ALDH1A1 (0.46) ALDH1A1LMNAHPGDHSD17B10MEN1
SCHEMBL3258766 0.74 HSD11B1 (0.54) HTTPIK3CA
SCHEMBL3256778 0.73 P2RY1 (0.49) MMP1MMP2MMP3MMP7MMP9
SCHEMBL3256970 0.72 ALOX12 (0.46) MMP1MMP2MMP3MMP7MMP9
SCHEMBL6623052 0.72 KMT2A (0.64) ALDH1A1LMNAMEN1KMT2APKM
SCHEMBL3253214 0.71 AKT1 (0.46) METAP2
SCHEMBL3250345 0.71 ALDH1A1 (0.49) ALDH1A1MMP2MMP9HPGDHSD17B10
SCHEMBL3256053 0.71 SCN3A (0.46) ALDH1A1LMNAMMP1MMP2MMP9
SCHEMBL3257519 0.71 KMO (0.48) ALDH1A1LMNAMMP1MMP2MMP3

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-1461325-B1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2010-05-26 — — EP claimed
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