SCHEMBL3942001

SCHEMBL3942001

COC(=O)Cc1cccc(C2CCCN(S(=O)(=O)c3cccc(Cl)c3)C2)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
BCL9 O00512 10/20 0.49
CTNNB1 P35222 10/20 0.49
TSHR P16473 1/20 0.49
RECQL P46063 1/20 0.48
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
POLB P06746 2/20 0.45
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
ATM Q13315 1/20 0.42

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
SCHEMBL3941279 0.94 BCL9 (0.46) MAPTBCL9CTNNB1TSHRRECQL
SCHEMBL3941513 0.92 SMN1; SMN2 (0.48) MAPTBCL9CTNNB1KMT2AMEN1
SCHEMBL3932848 0.90 BCL9 (0.47) BCL9CTNNB1ALDH1A1LMNAGAA
SCHEMBL3935876 0.90 BCL9 (0.50) BCL9CTNNB1KMT2AMEN1POLB
SCHEMBL3941097 0.89 PTGDR2 (0.51) MAPTBCL9CTNNB1TSHRRECQL
SCHEMBL3936109 0.87 ATM (0.47) MAPTBCL9CTNNB1TSHRPOLB
SCHEMBL3941453 0.87 BCL9 (0.47) BCL9CTNNB1KMT2AMEN1ALDH1A1
SCHEMBL3940272 0.87 ALDH1A1 (0.50) BCL9CTNNB1TSHRKMT2AMEN1
SCHEMBL3935829 0.86 NPC1 (0.53) BCL9CTNNB1TSHRKMT2AMEN1
SCHEMBL3936472 0.86 TP53 (0.48) BCL9CTNNB1KMT2AMEN1ALDH1A1

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