SCHEMBL7521692

SCHEMBL7521692

Cc1ccc(-c2cc(F)c(F)c(F)c2C2=NC(C)(C)CO2)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
IL2 P60568 1/20 0.43
KDM4E B2RXH2 1/20 0.38
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
HRH3 Q9Y5N1 4/20 0.34
CYP2D6 P10635 1/20 0.34
PTGS2 P35354 2/20 0.34
ABL1 P00519 1/20 0.33
PTGS1 P23219 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL3942245 0.75 KDM4E (0.53) LMNAMAPTHTTIL2KDM4E
SCHEMBL4447566 0.74 KDM4E (0.51) LMNAMAPTHTTIL2KDM4E
SCHEMBL9087397 0.74 HTT (0.43) LMNAMAPTHTTIL2KDM4E
SCHEMBL9088744 0.74 HTT (0.43) LMNAMAPTHTTIL2KDM4E
SCHEMBL371 0.74 KDM4E (0.49) LMNAMAPTHTTIL2KDM4E
SCHEMBL8630585 0.72 KDM4E (0.47) LMNAMAPTHTTIL2KDM4E
SCHEMBL10742028 0.72 ATM (0.47) LMNAMAPTHTTIL2KDM4E
SCHEMBL8560175 0.71 HTT (0.41) LMNAMAPTHTTIL2KDM4E
SCHEMBL20411007 0.71 HRH3 (0.54) LMNAMAPTHTTIL2KDM4E
SCHEMBL9087599 0.70 HTT (0.40) LMNAMAPTHTTIL2KDM4E

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-1122234-A9 Production methods of alpha, alpha, alpha-trifluoromethylphenyl-substituted benzoic acid and intermediate therefor SUMIKA FINE CHEMICALS Co., Ltd. (JP) 2002-01-16 EP disclosed
EP-1122234-A2 Production methods of alpha, alpha, alpha-trifluoromethylphenyl-substituted benzoic acid and intermediate therefor SUMIKA FINE CHEMICALS Co., Ltd. (JP) 2001-08-08 EP disclosed