SCHEMBL8525834

SCHEMBL8525834

Nc1cc(F)c(F)c(F)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA13 Q8N1Q1 1/20 0.31

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
SCHEMBL9153454 0.84 GRIN2D (0.36) GAAALDH1A1CYP3A4
SCHEMBL10616500 0.84 GAA (0.35) GAAALDH1A1CYP3A4CA12CA1
SCHEMBL2945946 0.79 GRIN2D (0.36) GAAALDH1A1
SCHEMBL28271960 0.79 GAA (0.35) GAAALDH1A1CA12CA1CA2
SCHEMBL25027697 0.78 THRB (0.36) GAAALDH1A1CYP3A4CA12CA1
SCHEMBL22831784 0.78 THRB (0.36) GAAALDH1A1CYP3A4CA12CA1
SCHEMBL3823002 0.78 KDM1A (0.32) GAAALDH1A1
SCHEMBL22832043 0.78 GAA (0.31) GAAALDH1A1
SCHEMBL10619327 0.78 GAA (0.31) GAAALDH1A1
SCHEMBL31150392 0.78 THRB (0.36) GAAALDH1A1CYP3A4CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0682008-B1 Substituted 2-chloro-3,4,5-trifluorobenzenes and process for their preparation CLARIANT GMBH (DE) 1998-12-30 EP claimed
CN-1041197-C Substituted 2-chloro-3,4,5-trifluorobenzenes and a process for their preparation HOECHST AG (DE) 1998-12-16 CN claimed
CN-1112917-A Substituted 2-chloro-3,4,5-trifluorobenzenes and a process for their preparation HOECHST AG (DE) 1995-12-06 CN claimed
EP-0682008-A1 Substituted 2-chloro-3,4,5-trifluorobenzenes and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1995-11-15 EP claimed
EP-0682008-B1 Substituted 2-chloro-3,4,5-trifluorobenzenes and process for their preparation CLARIANT GMBH (DE) 1998-12-30 EP disclosed
CN-1041197-C Substituted 2-chloro-3,4,5-trifluorobenzenes and a process for their preparation HOECHST AG (DE) 1998-12-16 CN disclosed
CN-1041197-C Substituted 2-chloro-3,4,5-trifluorobenzenes and a process for their preparation HOECHST AG (DE) 1998-12-16 CN disclosed
US-5565612-A Substituted 2-chloro-3,4,5-trifluorobenzenes and a process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-15 US disclosed
US-5565612-A Substituted 2-chloro-3,4,5-trifluorobenzenes and a process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-15 US disclosed
CN-1112917-A Substituted 2-chloro-3,4,5-trifluorobenzenes and a process for their preparation HOECHST AG (DE) 1995-12-06 CN disclosed
CN-1112917-A Substituted 2-chloro-3,4,5-trifluorobenzenes and a process for their preparation HOECHST AG (DE) 1995-12-06 CN disclosed
EP-0682008-A1 Substituted 2-chloro-3,4,5-trifluorobenzenes and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1995-11-15 EP disclosed
EP-0682008-A1 Substituted 2-chloro-3,4,5-trifluorobenzenes and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1995-11-15 EP disclosed