SCHEMBL3932848

SCHEMBL3932848

COC(=O)Cc1cccc(C2CCCN(S(=O)(=O)c3ccc(Cl)c(Cl)c3)C2)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 9/20 0.47
CTNNB1 P35222 9/20 0.47
ALDH1A1 P00352 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
NPC1 O15118 2/20 0.46
HTT P42858 2/20 0.46
LMNA P02545 2/20 0.46
USP2 O75604 1/20 0.46
CASP6 P55212 1/20 0.45
RAB9A P51151 2/20 0.45
ATM Q13315 1/20 0.45
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL3941513 0.91 SMN1; SMN2 (0.48) BCL9CTNNB1HTTLMNAUSP2
SCHEMBL3942001 0.90 MAPT (0.49) BCL9CTNNB1ALDH1A1HTTLMNA
SCHEMBL3941279 0.89 BCL9 (0.46) BCL9CTNNB1ATM
SCHEMBL3928445 0.89 BCL9 (0.47) BCL9CTNNB1ALDH1A1NPSR1LMNA
SCHEMBL3941453 0.88 BCL9 (0.47) BCL9CTNNB1ALDH1A1NPSR1NPC1
SCHEMBL3940272 0.88 ALDH1A1 (0.50) BCL9CTNNB1ALDH1A1HTTLMNA
SCHEMBL3936472 0.87 TP53 (0.48) BCL9CTNNB1ALDH1A1NPSR1NPC1
SCHEMBL3935876 0.87 BCL9 (0.50) BCL9CTNNB1GAA
SCHEMBL3935829 0.87 NPC1 (0.53) BCL9CTNNB1ALDH1A1NPSR1NPC1
SCHEMBL3933582 0.87 GAA (0.49) BCL9CTNNB1ALDH1A1NPSR1HTT

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
EP-2044017-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2009-04-08 EP disclosed
WO-2007146838-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-21 WO disclosed