SCHEMBL9302568

SCHEMBL9302568

CC(C)COC(=O)NCCOc1ccc(Cc2ccccc2)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
LMNA P02545 2/20 0.49
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LTA4H P09960 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 2/20 0.44
KDM4E B2RXH2 2/20 0.43
POLB P06746 1/20 0.43
PKM P14618 1/20 0.43
PTGER1 P34995 1/20 0.42
HRH4 Q9H3N8 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
AAK1 Q2M2I8 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL9283290 0.91 LTA4H (0.48) ALDH1A1LMNATSHRMAPK1HTT
SCHEMBL9160132 0.90 LTA4H (0.47) ALDH1A1LMNAMEN1KMT2ALTA4H
SCHEMBL9161991 0.89 LTA4H (0.43) ALDH1A1LMNATSHRMAPK1HTT
SCHEMBL9158248 0.88 LTA4H (0.49) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL9163445 0.88 LTA4H (0.45) ALDH1A1LMNAMEN1KMT2ALTA4H
SCHEMBL9281352 0.88 LTA4H (0.47) ALDH1A1LMNAMEN1KMT2ALTA4H
SCHEMBL9165444 0.87 SMN1; SMN2 (0.50) ALDH1A1LMNATSHRMAPK1HTT
SCHEMBL9163348 0.87 LTA4H (0.44) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL9157898 0.87 LTA4H (0.52) ALDH1A1TSHRMEN1KMT2ALTA4H
SCHEMBL9157899 0.86 ALDH1A1 (0.50) ALDH1A1TSHRMEN1KMT2ALTA4H

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
US-5346920-A Insecticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-09-13 US disclosed