SCHEMBL9219161

SCHEMBL9219161

CCC(O)CCCOc1ccccc1-c1ccc(OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.49
AURKB Q96GD4 1/20 0.49
INCENP Q9NQS7 1/20 0.49
MAPT P10636 4/20 0.45
L3MBTL1 Q9Y468 4/20 0.45
HPGD P15428 1/20 0.45
ATM Q13315 1/20 0.45
ADRB2 P07550 3/20 0.43
KDM4E B2RXH2 6/20 0.43
TDP1 Q9NUW8 2/20 0.43
KCNH2 Q12809 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
PKM P14618 1/20 0.43
ABL1 P00519 1/20 0.41
ABCB1 P08183 1/20 0.41
BCR P11274 1/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
MEN1 O00255 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
SCHEMBL9228166 0.88 ADRB2 (0.55) L3MBTL1ADRB2KDM4EPKMALDH1A1
SCHEMBL9219158 0.85 CYP11B1 (0.52) SYK
SCHEMBL28481944 0.82 AR (0.46) HPGDADRB2KDM4EPKMALDH1A1
SCHEMBL31019371 0.82 AR (0.46) HPGDADRB2KDM4EPKMALDH1A1
SCHEMBL28158844 0.80 SYK (0.59) SYKAURKBINCENPMAPTL3MBTL1
SCHEMBL27540487 0.75 SYK (0.48) SYKAURKBINCENPMAPTL3MBTL1
SCHEMBL6932590 0.75 L3MBTL1 (0.45) MAPTL3MBTL1ADRB2TDP1ALDH1A1
SCHEMBL5414689 0.74 KDM4E (0.43) L3MBTL1ADRB2KDM4EPKMALDH1A1
SCHEMBL5411263 0.72 PTPN11 (0.41) KDM4EALDH1A1HDAC8
SCHEMBL28725198 0.72 APP (0.46) MAPTL3MBTL1HPGDATMKDM4E

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
US-5412079-A Liquid crystal monomer compound and polymer obtained therefrom NIPPON PAINT CO., LTD. (JP) 1995-05-02 US disclosed
EP-0617110-A1 Liquid crystal monomer compound and polymer obtained therefrom Nippon Paint Co., Ltd. (JP) 1994-09-28 EP disclosed