SCHEMBL7335349

SCHEMBL7335349

CCOC(=O)C(CCc1ccccc1)S(C)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ MAPT P10636 1/20 0.47
▸ PIN1 Q13526 1/20 0.46
▸ MMP8 P22894 1/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ TSHR P16473 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ POLB P06746 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HSD17B10 Q99714 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
SCHEMBL5921 0.89 LMNA (0.57) L3MBTL1LMNAALDH1A1
SCHEMBL7323045 0.84 MMP8 (0.54) SMN1; SMN2MAPTPIN1MMP8L3MBTL1
SCHEMBL5923 0.82 MEN1 (0.41) MAPTMEN1KMT2ANPC1LMNA
SCHEMBL14125663 0.79 SMN1; SMN2 (0.52) SMN1; SMN2MAPTMMP8TDP1MEN1
SCHEMBL4224537 0.79 SMN1; SMN2 (0.49) SMN1; SMN2MAPTPIN1MMP8L3MBTL1
SCHEMBL935980 0.79 TDP1 (0.59) SMN1; SMN2MAPTPIN1MMP8L3MBTL1
SCHEMBL18065697 0.79 SMN1; SMN2 (0.57) SMN1; SMN2MAPTPIN1MMP8L3MBTL1
SCHEMBL3991999 0.78 SMN1; SMN2 (0.48) SMN1; SMN2MAPTPIN1MMP8L3MBTL1
SCHEMBL614649 0.78 SMN1; SMN2 (0.56) SMN1; SMN2MAPTPIN1MMP8L3MBTL1
SCHEMBL8224624 0.78 SMN1; SMN2 (0.60) SMN1; SMN2MAPTPIN1MMP8L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4914129-A Antihypertensive 5-amino-4-hydroxyvaleryl derivatives substituted by sulphur-containing groups CIBA-GEIGY CORPORATION (US) 1990-04-03 — — US disclosed
US-4889869-A ANTIALDOSTERONISM AGENTS CIBA-GEIGY CORPORATION (US) 1989-12-26 — — US disclosed
US-4758584-A Antihypertensive 5-amino-4-hydroxyvaleryl derivatives substituted by sulphur-containing groups CIBA-GEIGY CORPORATION (US) 1988-07-19 — — US disclosed
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