SCHEMBL10352013

SCHEMBL10352013

CCC(C)COc1ccc(C(F)(F)F)cc1N

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.55
MAPT P10636 4/20 0.55
ATM Q13315 2/20 0.55
LMNA P02545 1/20 0.55
RAB9A P51151 1/20 0.48
NPSR1 Q6W5P4 1/20 0.45
TLR8 Q9NR97 1/20 0.44
MCHR1 Q99705 1/20 0.41
CFTR P13569 1/20 0.39
CYP2C19 P33261 2/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
PDE2A O00408 1/20 0.37
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 3/20 0.37
MEN1 O00255 2/20 0.37
USP2 O75604 2/20 0.37
CASP1 P29466 2/20 0.37
KMT2A Q03164 2/20 0.37
HSD17B10 Q99714 2/20 0.37

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
SCHEMBL10352017 0.86 L3MBTL1 (0.55) L3MBTL1MAPTATMLMNARAB9A
SCHEMBL2241258 0.81 L3MBTL1 (0.72) L3MBTL1MAPTATMLMNARAB9A
SCHEMBL10352191 0.80 L3MBTL1 (0.49) L3MBTL1MAPTATMLMNARAB9A
SCHEMBL10352024 0.79 L3MBTL1 (0.54) L3MBTL1MAPTATMLMNARAB9A
SCHEMBL10352193 0.78 L3MBTL1 (0.60) L3MBTL1MAPTATMLMNARAB9A
SCHEMBL10352661 0.78 L3MBTL1 (0.52) L3MBTL1MAPTATMLMNARAB9A
SCHEMBL10352025 0.77 L3MBTL1 (0.62) L3MBTL1MAPTATMLMNARAB9A
SCHEMBL10437691 0.77 MAPT (0.50) L3MBTL1MAPTATMLMNARAB9A
SCHEMBL3279070 0.76 ALDH1A1 (0.63) L3MBTL1MAPTATMLMNARAB9A
SCHEMBL10352659 0.76 L3MBTL1 (0.57) L3MBTL1MAPTATMLMNARAB9A

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-0300390-B1 TRIFLUOROMETHYL-ALKOXY-ANILIN, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE ICE-COLOUR TECHNIQUE HOECHST AKTIENGESELLSCHAFT (DE) 1990-08-29 EP disclosed
EP-0300390-A1 Trifluoromethyl-alkoxy-anilin, process for their preparation and their use in the ice-colour technique HOECHST AKTIENGESELLSCHAFT (DE) 1989-01-25 EP disclosed