SCHEMBL6533989

SCHEMBL6533989

CC(C)Oc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)c2ccnc(C(F)(F)F)c2)cc1.Cc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)c2ccccn2)cc1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR9 P51686 16/20 0.62
LMNA P02545 2/20 0.53
HTT P42858 2/20 0.53
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL6533991 0.92 CCR9 (0.54) CCR9LMNAHTTTP53MAPT
SCHEMBL33250 0.90 CCR9 (0.63) CCR9LMNAHTTTP53MAPT
SCHEMBL27682 0.82 CCR9 (0.79) CCR9LMNAHTTTP53MAPT
SCHEMBL344197 0.81 CCR9 (0.74) CCR9LMNAHTTTP53MAPT
SCHEMBL12359421 0.80 CCR9 (0.62) CCR9LMNAHTTTP53MAPT
SCHEMBL17395274 0.79 CCR9 (0.66) CCR9LMNAHTTTP53MAPT
SCHEMBL28061 0.79 CCR9 (0.63) CCR9LMNAHTTTP53MAPT
SCHEMBL29238 0.78 CCR9 (0.64) CCR9LMNAHTTTP53MAPT
SCHEMBL27420 0.78 CCR9 (0.68) CCR9LMNAHTTTP53MAPT
SCHEMBL27433 0.77 CCR9 (0.74) CCR9LMNAHTTTP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005112925-A1 ARYL SULFONAMIDES CHEMOCENTRYX (US) 2005-12-01 WO disclosed