SCHEMBL6935290

SCHEMBL6935290

COC(=O)Cc1ccccc1Sc1cccc(O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.60
MMP2 P08253 4/20 0.46
MMP9 P14780 4/20 0.46
MMP12 P39900 4/20 0.46
MMP14 P50281 1/20 0.46
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 1/20 0.42
ALDH1A1 P00352 3/20 0.41
GAA P10253 2/20 0.41
GFER P55789 1/20 0.41
KDM4E B2RXH2 3/20 0.41
EGFR P00533 1/20 0.41
GLA P06280 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HSP90AB1 P08238 1/20 0.41
CYP2D6 P10635 1/20 0.40

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
SCHEMBL6932450 0.86 MMP2 (0.54) SMN1; SMN2MMP2MMP9MMP12MMP14
SCHEMBL9151160 0.85 MMP2 (0.54) SMN1; SMN2MMP2MMP9MMP12MMP14
SCHEMBL9148637 0.83 MMP2 (0.49) SMN1; SMN2MMP2MMP9MMP12MMP14
SCHEMBL9360605 0.83 MMP2 (0.49) SMN1; SMN2MMP2MMP9MMP12MMP14
SCHEMBL6935218 0.79 MMP2 (0.43) SMN1; SMN2MMP2MMP9MMP12MMP14
SCHEMBL6934243 0.77 SMN1; SMN2 (0.50) SMN1; SMN2LMNAALDH1A1KDM4EEGFR
SCHEMBL9430367 0.76 LMNA (0.51) MMP2MMP9MMP12MMP14HPGD
SCHEMBL10341596 0.75 SLC6A4 (0.69) SMN1; SMN2LMNAALDH1A1GAAGFER
SCHEMBL7708631 0.74 L3MBTL1 (0.45) SMN1; SMN2MMP2MMP9MMP12MMP14
SCHEMBL8147162 0.73 LMNA (0.54) SMN1; SMN2CYP2C9CYP2C19HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1086079-B1 DERIVATIVES OF HYDROXYPHENYLSULFANYLBENZOIC AND HYDROXYPHENYLSULFANYLARYLACETIC ACIDS LECIVA A S (CZ) 2003-05-07 EP disclosed
US-6303612-B1 USED AS ANTIINFLAMMATORY AND/OR ANTIASTHMATIC AGENTS LECIVA, A.S. (CZ) 2001-10-16 US disclosed
EP-1086079-A1 DERIVATIVES OF HYDROXYPHENYLSULFANYLBENZOIC AND HYDROXYPHENYLSULFANYLARYLACETIC ACIDS Leciva, A.S. (CZ) 2001-03-28 EP disclosed
WO-1999067208-A1 DERIVATIVES OF HYDROXYPHENYLSULFANYLBENZOIC AND HYDROXYPHENYLSULFANYLARYLACETIC ACIDS LECIVA, A.S. (CZ) 1999-12-29 WO disclosed
US-5468857-A Phenylmethoxypropenoic esters IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-11-21 US disclosed
EP-0307103-B1 Fungicides ZENECA LTD (GB) 1994-09-21 EP disclosed
US-5334748-A A methyl 2-aryl heterofunctional phenoxyphenyl-3-methoxy-propenoate compound; treating the plant diseases IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-08-02 US disclosed
EP-0307103-A2 Fungicides ZENECA LIMITED (GB) 1989-03-15 EP disclosed