SCHEMBL4017920

SCHEMBL4017920

COC(=O)Cc1cccc(C2=CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.44
MAPT P10636 1/20 0.43
HSD11B1 P28845 3/20 0.42
CTSG P08311 2/20 0.41
CMA1 P23946 2/20 0.41
KDM4E B2RXH2 4/20 0.40
KMT2A Q03164 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL4011931 0.88 KDM4E (0.46) PKMHSD11B1KDM4EKMT2ACHRNB2
SCHEMBL4013731 0.82 KDM4E (0.44) PKMMAPTKDM4EKMT2AALDH1A1
SCHEMBL29140052 0.81 HSD11B1 (0.56) PKMMAPTHSD11B1KDM4EKMT2A
SCHEMBL14366673 0.77 PKM (0.44) PKMMAPTCTSGCMA1KDM4E
SCHEMBL29140059 0.76 KDM4E (0.65) PKMHSD11B1KDM4EKMT2AALDH1A1
SCHEMBL4012261 0.76 SLC7A5 (0.43) PKMMAPTCTSGCMA1ALDH1A1
SCHEMBL3941870 0.75 PKM (0.55) PKMMAPTKMT2ATSHRHTT
SCHEMBL4013512 0.75 KMT2A (0.55) PKMMAPTKDM4EKMT2AALDH1A1
SCHEMBL3933582 0.72 GAA (0.49) PKMMAPTKDM4EKMT2AALDH1A1
SCHEMBL4016687 0.72 GPR119 (0.40)

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 5 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 claimed
WO-2007146838-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-21 WO claimed
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
WO-2007146838-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-21 WO disclosed