SCHEMBL3930700

SCHEMBL3930700

CC1C(c2cccc(CC(=O)O)c2)CCCN1S(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.46
THRB P10828 1/20 0.44
PTGDR2 Q9Y5Y4 5/20 0.43
ATM Q13315 1/20 0.43
GLA P06280 1/20 0.42
HTR7 P34969 1/20 0.42
TSHR P16473 2/20 0.42
LMNA P02545 1/20 0.41
ALDH1A1 P00352 1/20 0.41
FKBP1A P62942 1/20 0.41
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL3933560 0.90 THRB (0.44) TRPA1THRBATMGLATSHR
SCHEMBL3928274 0.83 TRPA1 (0.57) TRPA1TSHRLMNAALDH1A1FKBP1A
SCHEMBL3934209 0.80 USP5 (0.47) PTGDR2TSHRALDH1A1MAPT
SCHEMBL3933335 0.80 FKBP1A (0.45) PTGDR2TSHRALDH1A1FKBP1A
SCHEMBL3933383 0.79 PTGDR2 (0.47) TRPA1PTGDR2
SCHEMBL3938045 0.78 MAPT (0.55) PTGDR2TSHRLMNAALDH1A1MAPT
SCHEMBL3929084 0.78 MAPT (0.55) PTGDR2TSHRLMNAALDH1A1MAPT
SCHEMBL3941517 0.78 MAPT (0.55) PTGDR2TSHRLMNAALDH1A1MAPT
SCHEMBL3942010 0.77 USP5 (0.61) PTGDR2TSHR
SCHEMBL3931870 0.77 PTGDR2 (0.49) PTGDR2TSHRALDH1A1MAPT

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