SCHEMBL11208145

SCHEMBL11208145

CCNC(c1ccc(OCc2ccc(C)cc2)cc1)C(Cl)(Cl)Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.46
HRH3 Q9Y5N1 2/20 0.44
MAPK1 P28482 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
MAOB P27338 3/20 0.43
PARP10 Q53GL7 1/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
CASP3 P42574 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
BCHE P06276 1/20 0.39
CYP1A2 P05177 1/20 0.38

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
SCHEMBL11209448 0.88 BCHE (0.48) MAPK1ALDH1A1MAPTMAOBNPC1
SCHEMBL11208063 0.87 FFAR1 (0.43) FFAR1HRH3MAPK1ALDH1A1MAPT
SCHEMBL11207912 0.80 MAPT (0.47) ALDH1A1MAPTMAOBSMN1; SMN2KMT2A
SCHEMBL11211010 0.77 HDAC3 (0.48) MAPK1MEN1KMT2APOLBNPSR1
SCHEMBL11211662 0.75 SIGMAR1 (0.48) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL11210926 0.75 BCHE (0.52) MAPK1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL11283415 0.74 HDAC3 (0.43) FFAR1ALDH1A1
SCHEMBL13929692 0.74 MAOB (0.61) FFAR1HRH3MAPK1ALDH1A1MAPT
SCHEMBL15336496 0.74 MAOB (0.61) FFAR1HRH3MAPK1ALDH1A1MAPT
SCHEMBL11276905 0.74 MRGPRX4 (0.40) MAPK1ALDH1A1MEN1KMT2APOLB

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-0051196-B1 4-BENZYLOXY-ALPHA-TRICHLOROMETHYLBENZYL AMINES, PROCESS FOR THEIR PREPARATION, PESTICIDAL COMPOSITIONS CONTAINING THEM, THEIR PREPARATION AND USE BAYER AG (DE) 1983-11-09 EP disclosed
EP-0051196-A1 4-Benzyloxy-alpha-trichloromethylbenzyl amines, process for their preparation, pesticidal compositions containing them, their preparation and use BAYER AG (DE) 1982-05-12 EP disclosed