SCHEMBL8566023

SCHEMBL8566023

O=S(=O)(NC(Cc1ccccc1)c1ccccc1)c1ccc(CBr)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.53
ATM Q13315 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MMP2 P08253 8/20 0.48
MMP9 P14780 6/20 0.48
ADAMTS4 O75173 1/20 0.48
EEF2K O00418 2/20 0.46
MMP1 P03956 1/20 0.46
MMP3 P08254 1/20 0.46
MMP7 P09237 1/20 0.46
MMP13 P45452 1/20 0.46
S1PR1 P21453 6/20 0.46
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45

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
SCHEMBL16300320 0.84 CA2 (0.63) ALDH1A1ATML3MBTL1MMP9S1PR1
SCHEMBL30801085 0.84 CA2 (0.63) ALDH1A1ATML3MBTL1MMP9S1PR1
SCHEMBL1409291 0.82 DUT (0.54) ALDH1A1ATML3MBTL1MMP2MMP9
SCHEMBL9512699 0.79 ADAMTS5 (0.54) ALDH1A1ATML3MBTL1MMP2S1PR1
SCHEMBL9501945 0.76 ALDH1A1 (0.47) ALDH1A1ATML3MBTL1MMP2MMP9
SCHEMBL9298870 0.76 PIN1 (0.55) ALDH1A1MMP2MMP9ADAMTS4MMP1
SCHEMBL7870945 0.75 POLB (0.53) ALDH1A1ATML3MBTL1MMP2MMP9
SCHEMBL8895531 0.75 MMP2 (0.53) ALDH1A1ATML3MBTL1MMP2MMP9
SCHEMBL8895575 0.75 NPSR1 (0.56) ALDH1A1ATML3MBTL1MMP2S1PR1
SCHEMBL8895021 0.74 NPSR1 (0.52) ALDH1A1ATML3MBTL1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543861-B1 IMIDAZOPYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIOTECH PHARM (GB) 1998-10-14 EP disclosed
US-5276153-A Antagonist of platelet activating factor for bronchodilation BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-01-04 US disclosed
WO-1993015047-A1 AMINO ACID DERIVATIVES AS PAF ANTAGONISTS BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-08-05 WO disclosed
EP-0543861-A1 IMIDAZOPYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-06-02 EP disclosed
US-5180723-A Hypertensives, bronchodilators, antiedemic agents BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-01-19 US disclosed
WO-1992003422-A1 BENZIMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-03-05 WO disclosed