SCHEMBL5711222

SCHEMBL5711222

O=CCCC[C@@H]1C(=O)OCN1C(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.61
PSEN1 P49768 1/20 0.45
PSEN2 P49810 1/20 0.45
APH1B Q8WW43 1/20 0.45
NCSTN Q92542 1/20 0.45
APH1A Q96BI3 1/20 0.45
PSENEN Q9NZ42 1/20 0.45
ELANE P08246 3/20 0.43
F2 P00734 2/20 0.43
CTSG P08311 1/20 0.43
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL5711344 1.00 USP2 (0.61) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711223 0.97 USP2 (0.60) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711245 0.93 USP2 (0.64) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711276 0.93 USP2 (0.64) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL8694697 0.93 USP2 (0.64) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5218287 0.87 USP2 (0.62) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5218306 0.87 USP2 (0.62) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711402 0.86 USP2 (0.61) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711279 0.86 USP2 (0.61) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711372 0.86 USP2 (0.66) USP2PSEN1PSEN2APH1BNCSTN

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-1103560-B1 NOVEL THIAZOLIDINE DERIVATIVES SANTEN PHARMACEUTICAL CO LTD (JP) 2006-12-27 EP disclosed
US-6410576-B1 ANTIINFLAMMATORY AGENTS; CARDIOVASCULAR DISORDERS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-06-25 US disclosed
EP-1103560-A1 NOVEL THIAZOLIDINE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-05-30 EP disclosed