SCHEMBL4445336

SCHEMBL4445336

C=C(C(=O)O)C(=O)N(O)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.50
RIPK1 Q13546 1/20 0.49
CA12 O43570 1/20 0.47
CA9 Q16790 1/20 0.47
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
LMNA P02545 2/20 0.42
HPGD P15428 1/20 0.41
ALDH1A1 P00352 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TSHR P16473 1/20 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
SCHEMBL6360912 0.82 ALOX5 (0.55) ALOX5RIPK1CA12CA9PTGS1
SCHEMBL628573 0.81 RIPK1 (0.53) ALOX5RIPK1CA12CA9PTGS1
SCHEMBL3279004 0.79 ALOX5 (0.60) ALOX5RIPK1CA12CA9PTGS1
SCHEMBL23805084 0.78 ALOX5 (0.55) ALOX5RIPK1CA12CA9PTGS1
SCHEMBL11127626 0.75 ALOX5 (0.56) ALOX5RIPK1CA12CA9PTGS1
SCHEMBL6360909 0.74 ALOX5 (0.51) ALOX5RIPK1CA12CA9PTGS1
SCHEMBL6037547 0.74 ALOX5 (0.56) ALOX5RIPK1CA12CA9PTGS1
SCHEMBL1436622 0.74 ALOX5 (0.70) ALOX5RIPK1CA12CA9PTGS1
SCHEMBL28159112 0.73 ALOX5 (0.50) ALOX5RIPK1CA12CA9PTGS1
SCHEMBL7646415 0.72 HSD11B1 (0.54) ALOX5RIPK1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7521506-B2 Emulsifier-free microgel BOLLIG & KEMPER GMBH & CO. KG (DE) 2009-04-21 US disclosed
US-20060128859-A1 Emulsifier-free microgel BOLLIG & KEMPER GMBH & CO. KG (DE) 2006-06-15 US disclosed