SCHEMBL8180473

SCHEMBL8180473

CCOC(=O)CS(=O)(=O)NCc1sc2cc(OC)c(OC)cc2c1Oc1ccc(OC)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ALDH1A1 P00352 4/20 0.38
▸ MAPT P10636 3/20 0.37
▸ LMNA P02545 3/20 0.37
▸ KDR P35968 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ ESR1 P03372 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ PTGS2 P35354 1/20 0.33

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
SCHEMBL7399212 0.88 L3MBTL1 (0.43) L3MBTL1MAPTLMNAKDRESR1
SCHEMBL8168027 0.87 L3MBTL1 (0.43) L3MBTL1KDRESR1SMN1; SMN2KDM4E
SCHEMBL8167640 0.81 L3MBTL1 (0.42) L3MBTL1ALDH1A1MAPTKDRCYP1A2
SCHEMBL8174500 0.77 L3MBTL1 (0.44) L3MBTL1ALDH1A1MAPTLMNAKDM4E
SCHEMBL7391101 0.76 CA12 (0.44) L3MBTL1ALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL7395385 0.76 L3MBTL1 (0.46) L3MBTL1MAPTLMNAKDRESR1
Ammonia Solution, Strong SCHEMBL8176215 0.75 CA12 (0.43) L3MBTL1ALDH1A1MAPTSMN1; SMN2MEN1
Ammonia Solution, Strong SCHEMBL8176216 0.75 CA12 (0.43) L3MBTL1ALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL8180444 0.74 L3MBTL1 (0.44) L3MBTL1ALDH1A1MAPTLMNAKDR
SCHEMBL8175134 0.74 PPARG (0.44) L3MBTL1ALDH1A1MAPTLMNAKDR

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-6048875-A CARDIOVASCULAR DISORDERS; REDUCING THROMBOSIS ADIR ET COMPAGNIE (FR) 2000-04-11 — — US disclosed
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