SCHEMBL7052844

SCHEMBL7052844

O=C(O)CCNS(=O)(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.54
GAA P10253 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
KMT2A Q03164 1/20 0.52
FABP4 P15090 6/20 0.51
TBXA2R P21731 2/20 0.50
ALDH1A1 P00352 1/20 0.50
TSHR P16473 1/20 0.47

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
SCHEMBL31381967 0.83 GAA (0.55) ATMGAAKMT2A
SCHEMBL12916500 0.83 FABP4 (0.51) ATML3MBTL1FABP4TBXA2RALDH1A1
SCHEMBL2949015 0.82 FABP4 (0.57) ATMGAAL3MBTL1FABP4TBXA2R
SCHEMBL27552122 0.79 FABP4 (0.42) ATMFABP4ALDH1A1
SCHEMBL6186899 0.77 CYP3A4 (0.54) ATML3MBTL1KMT2AALDH1A1TSHR
SCHEMBL1200801 0.75 ALDH1A1 (0.75) ATMGAATBXA2RALDH1A1
SCHEMBL9778050 0.75 GAA (0.48) GAAL3MBTL1KMT2ATBXA2RALDH1A1
SCHEMBL27571698 0.75 ALDH1A1 (0.43) ATML3MBTL1KMT2AFABP4ALDH1A1
SCHEMBL2945116 0.75 TBXA2R (0.66) GAAFABP4TBXA2RALDH1A1TSHR
SCHEMBL6762534 0.75 SLC1A3 (0.48) ATMGAAL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1307226-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS Bristol-Myers Squibb Pharma Company (US) 2003-05-07 EP claimed
WO-2001097848-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-12-27 WO claimed
EP-1307226-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS Bristol-Myers Squibb Pharma Company (US) 2003-05-07 EP disclosed
WO-2001097848-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-12-27 WO disclosed