SCHEMBL5069496

SCHEMBL5069496

CC(C)(C)c1ccc(S(=O)(=O)Nc2cccc(Cl)c2C(=O)c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR9 P51686 6/20 0.58
HSD17B2 P37059 6/20 0.57
UQCRB P14927 1/20 0.57
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
KDM4E B2RXH2 1/20 0.51
TSHR P16473 1/20 0.51
PTK2B Q14289 1/20 0.51
CCR2 P41597 1/20 0.51
PSD A5PKW4 1/20 0.50
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
GLA P06280 1/20 0.49
RAB9A P51151 1/20 0.49
ATM Q13315 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
GLO1 Q04760 1/20 0.48
BDKRB1 P46663 1/20 0.47

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
SCHEMBL14660188 0.89 CCR9 (0.66) CCR9HSD17B2UQCRBCA1CA2
SCHEMBL2530482 0.83 CCR9 (0.81) CCR9HSD17B2UQCRBCCR2PSD
SCHEMBL15777052 0.83 CCR9 (0.56) CCR9HSD17B2UQCRBGLO1
SCHEMBL5628909 0.81 CCR9 (0.49) CCR9KDM4ETSHRPTK2BCCR2
SCHEMBL27490 0.79 CCR9 (0.78) CCR9HSD17B2CCR2LMNAHTT
SCHEMBL12221304 0.79 CCR9 (0.66) CCR9HSD17B2UQCRBCCR2LMNA
SCHEMBL7587850 0.77 HSD17B2 (0.79) HSD17B2UQCRBCA1CA2KDM4E
SCHEMBL8278412 0.77 TSHR (0.57) KDM4ETSHRPTK2BCCR2ALDH1A1
SCHEMBL10222599 0.77 CCR9 (0.55) CCR9HSD17B2UQCRBCCR2LMNA
SCHEMBL1104723 0.76 CCR9 (0.56) CCR9HSD17B2UQCRBPSD

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
EP-1567486-B1 BIS-ARYL SULFONAMIDES CHEMOCENTRYX INC (US) 2008-01-16 EP claimed