SCHEMBL7356375

SCHEMBL7356375

CCCCC(CCCC)(C(=O)O)C(=O)O.O=C(O)C(Cc1ccccc1)(Cc1ccccc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
MMP1 P03956 1/20 0.42
MMP9 P14780 1/20 0.42
MMP13 P45452 1/20 0.42
ARG1 P05089 1/20 0.41
ARG2 P78540 1/20 0.41
EPHX2 P34913 1/20 0.41
PTPRC P08575 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPRB P23467 1/20 0.40
PTPRG P23470 1/20 0.40
ACP1 P24666 1/20 0.40
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CETP P11597 3/20 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
SCHEMBL28003878 0.95 SMN1; SMN2 (0.47) SMN1; SMN2HIF1AALDH1A1LMNAMMP1
SCHEMBL31147036 0.90 SMN1; SMN2 (0.46) SMN1; SMN2HIF1AALDH1A1LMNAMMP1
SCHEMBL7008212 0.88 MMP1 (0.47) SMN1; SMN2HIF1AALDH1A1LMNAMMP1
SCHEMBL8376369 0.86 SMN1; SMN2 (0.40) SMN1; SMN2HIF1AALDH1A1LMNAMMP1
SCHEMBL27869079 0.84 SMN1; SMN2 (0.50) SMN1; SMN2HIF1AALDH1A1LMNAARG1
SCHEMBL9143721 0.84 PTPN1 (0.51) ALDH1A1LMNAPTPRCPTPN2PTPN1
SCHEMBL338742 0.83 SMN1; SMN2 (0.61) SMN1; SMN2HIF1AALDH1A1LMNAARG1
SCHEMBL7356368 0.82 SMN1; SMN2 (0.37) SMN1; SMN2HIF1AALDH1A1LMNAMMP1
SCHEMBL11172488 0.82 PTPRB (0.58) ALDH1A1PTPRCPTPN2PTPN1PTPRB
SCHEMBL1487540 0.81 BLM (0.51) SMN1; SMN2HIF1AALDH1A1LMNA

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-0722321-A4 SULFOXIMINE AND SULFODIIMINE MATRIX METALLOPROTEINASE INHIBITORS UNIV FLORIDA STATE (US) 1998-04-15 EP disclosed
EP-0722321-A1 SULFOXIMINE AND SULFODIIMINE MATRIX METALLOPROTEINASE INHIBITORS FLORIDA STATE UNIVERSITY (US) 1996-07-24 EP disclosed
WO-1995009620-A1 SULFOXIMINE AND SULFODIIMINE MATRIX METALLOPROTEINASE INHIBITORS FLORIDA STATE UNIVERSITY (US) 1995-04-13 WO disclosed