SCHEMBL9777953

SCHEMBL9777953

O=C(O)Cc1ccc(C(=O)CNS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 1/20 0.61
KAT6A Q92794 2/20 0.53
MMP1 P03956 1/20 0.51
GAA P10253 1/20 0.51
MMP12 P39900 1/20 0.51
TBXA2R P21731 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
PKM P14618 1/20 0.49
TBXAS1 P24557 1/20 0.48
CXCR4 P61073 1/20 0.47
EGFR P00533 3/20 0.47
ERBB2 P04626 3/20 0.47
KEAP1 Q14145 1/20 0.46
AKR1B1 P15121 1/20 0.46

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
SCHEMBL9777986 0.87 TBXA2R (0.67) MEP1BKAT6AMMP1TBXA2REGFR
SCHEMBL5899544 0.86 KAT6A (0.58) MEP1BKAT6AMMP1GAAMMP12
SCHEMBL9777957 0.86 ALDH1A1 (0.64) KAT6AMMP1GAAMMP12TBXA2R
SCHEMBL9452076 0.85 MEP1B (0.58) MEP1BKAT6ATBXA2R
SCHEMBL9777990 0.85 MEP1B (0.50) MEP1BKAT6AMMP1GAAMMP12
SCHEMBL5899467 0.83 KAT6A (0.72) MEP1BKAT6AMMP1GAAMMP12
SCHEMBL7668876 0.82 MMP1 (0.63) MEP1BMMP1GAAMMP12KDM4E
SCHEMBL11105032 0.81 KEAP1 (0.71) MEP1BTBXA2RKDM4EALDH1A1CXCR4
SCHEMBL10461554 0.79 TBXA2R (0.76) MEP1BTBXA2RALDH1A1TBXAS1
SCHEMBL23014260 0.78 KAT6A (0.52) MEP1BKAT6AMMP1GAAMMP12

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
EP-0345572-A2 Sulfonamide derivatives, their preparation and pharmaceuticals containing them BASF Aktiengesellschaft (DE) 1989-12-13 EP claimed
US-4999345-A Anticoagulants BASF AKTIENGESELLSCHAFT (DE) 1991-03-12 US disclosed
EP-0345572-A2 Sulfonamide derivatives, their preparation and pharmaceuticals containing them BASF Aktiengesellschaft (DE) 1989-12-13 EP disclosed