SCHEMBL3143535

SCHEMBL3143535

CCC(=O)C[C@](N)(C(=O)O)c1ccccc1OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.39
ATM Q13315 1/20 0.39
CTSD P07339 1/20 0.39
GAA P10253 3/20 0.38
CTNNB1 P35222 1/20 0.38
WNT3A P56704 1/20 0.38
LMNA P02545 2/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
HPGD P15428 1/20 0.36
NPC1 O15118 1/20 0.36
APLNR P35414 1/20 0.36

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
SCHEMBL2623830 0.82 MEN1 (0.43) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL11023514 0.73 KMT2A (0.47) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL4883362 0.72 POLB (0.41) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL6892090 0.72 POLB (0.50) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL30040484 0.72 POLB (0.50) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
1,2-Dimethoxybenzene SCHEMBL27275892 0.72 CA1 (0.59) KMT2APOLBSMN1; SMN2ALDH1A1CTSD
SCHEMBL21632350 0.70 GAA (0.44) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL21632078 0.70 ATM (0.48) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL17102000 0.70 KMT2A (0.49) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL3805381 0.69 HPGD (0.45) MEN1KMT2APOLBSMN1; SMN2HPGD

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
US-7705050-B2 Amides, useful in the inhibition of IL-8-induced chemotaxis of neutrophils DOMPÉ FARMACEUTICI S.P.A. (IT) 2010-04-27 US disclosed
EP-1255726-B1 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8 INDUCED CHEMIOTAXIS OF NEUTROPHILS DOMPE PHA R MA SPA RES & MFG (IT) 2009-11-11 EP disclosed
EP-1255726-A2 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8 INDUCED CHEMIOTAXIS OF NEUTROPHILS Dompé S.P.A. (IT) 2002-11-13 EP disclosed
WO-2001058852-A2 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8-INDUCED CHEMIOTAXIS OF NEUTROPHILS Dompé S.p.A. (IT) 2001-08-16 WO disclosed