SCHEMBL8363035

SCHEMBL8363035

O=C(O)Cc1ccccc1Sc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 6/20 0.71
MMP9 P14780 6/20 0.71
MMP12 P39900 6/20 0.71
CYP2C9 P11712 2/20 0.68
CYP2C19 P33261 2/20 0.68
HPGD P15428 1/20 0.68
MMP14 P50281 2/20 0.52
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
SRD5A2 P31213 1/20 0.48
ALDH1A1 P00352 1/20 0.46
CAMK2A Q9UQM7 1/20 0.46
MMP8 P22894 1/20 0.45
MMP13 P45452 1/20 0.45
MMP16 P51512 1/20 0.45
FFAR1 O14842 1/20 0.44
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
AKR1B1 P15121 1/20 0.43

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
SCHEMBL316248 0.92 MMP2 (0.85) MMP2MMP9MMP12CYP2C9CYP2C19
SCHEMBL9152799 0.88 CYP2C9 (0.57) MMP2MMP9MMP12CYP2C9CYP2C19
SCHEMBL315440 0.87 MMP2 (0.92) MMP2MMP9MMP12CYP2C9CYP2C19
SCHEMBL3765157 0.85 HPGD (0.78) MMP2MMP9MMP12CYP2C9CYP2C19
SCHEMBL5905654 0.83 MMP2 (0.64) MMP2MMP9MMP12CYP2C9CYP2C19
SCHEMBL315140 0.83 MMP2 (1.00) MMP2MMP9MMP12CYP2C9CYP2C19
SCHEMBL6933325 0.83 CYP2C9 (0.74) MMP2MMP9MMP12CYP2C9CYP2C19
SCHEMBL8228112 0.83 MMP2 (0.76) MMP2MMP9MMP12CYP2C9CYP2C19
SCHEMBL8229735 0.81 CYP2C9 (0.72) MMP2MMP9MMP12CYP2C9CYP2C19
SCHEMBL4734978 0.81 CYP2C9 (0.72) MMP2MMP9MMP12CYP2C9CYP2C19

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
WO-2003007954-A2 SULFONYL ARYL HYDROXAMATES AND THEIR USE AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2003-01-30 WO disclosed