SCHEMBL21795756

SCHEMBL21795756

Clc1ccc(OCc2ccccn2)c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 6/20 0.60
MAPT P10636 6/20 0.55
LMNA P02545 5/20 0.55
ALDH1A1 P00352 4/20 0.55
KMT2A Q03164 3/20 0.55
TDP1 Q9NUW8 2/20 0.55
HPGD P15428 2/20 0.55
MEN1 O00255 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
HTT P42858 1/20 0.55
GPR84 Q9NQS5 1/20 0.49
KDM4E B2RXH2 4/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
SLC6A4 P31645 1/20 0.47
AURKB Q96GD4 3/20 0.47
INCENP Q9NQS7 3/20 0.47
ABCB1 P08183 1/20 0.47
HTR1A P08908 1/20 0.47
DRD2 P14416 1/20 0.47

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
SCHEMBL21795746 0.83 MAPT (0.57) MAPTLMNAALDH1A1KMT2ATDP1
SCHEMBL4342702 0.80 SYK (0.67) SYKMAPTHPGDHTTKDM4E
SCHEMBL30853451 0.80 SYK (0.67) SYKMAPTHPGDHTTKDM4E
Ammonia Solution, Strong SCHEMBL4267568 0.78 SYK (0.65) SYKMAPTHPGDHTTKDM4E
Hydrochloric Acid SCHEMBL27878170 0.77 SYK (0.63) SYKMAPTLMNAKMT2AHPGD
SCHEMBL2937858 0.77 NISCH (0.54) SYKMAPTALDH1A1KMT2ATDP1
SCHEMBL29568574 0.76 SYK (0.58) SYKMAPTHPGDHTTSLC6A4
SCHEMBL21340419 0.76 SYK (0.58) SYKMAPTHPGDHTTSLC6A4
SCHEMBL2760112 0.75 SYK (0.59) SYKMAPTKMT2AHPGDMEN1
SCHEMBL17601189 0.75 SYK (1.00) SYKMAPTKMT2AHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3619196-A1 2-{[2-(PHENYLOXYMETHYL)PYRIDIN-5-YL]OXY}-ETHANAMIN-DERIVATIVES AND RELATED COMPOUNDS AS PEST-CONTROL AGENTS E.G. FOR THE PROTECTION OF PLANTS Bayer CropScience Aktiengesellschaft (DE) 2020-03-11 EP disclosed