SCHEMBL11052045

SCHEMBL11052045

CCCCCCC(Br)[C]=O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.48
PPARD Q03181 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
ZDHHC7 Q9NXF8 1/20 0.44
MAPT P10636 1/20 0.43
GPR84 Q9NQS5 5/20 0.40
FDPS P14324 3/20 0.40
FFAR1 O14842 1/20 0.40
LMNA P02545 1/20 0.39
DNM1 Q05193 1/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
FAAH O00519 1/20 0.38
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH4 P08319 1/20 0.38
ADH7 P40394 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
SCHEMBL10936156 1.00 LCK (0.48) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL7968657 0.98
SCHEMBL7261221 0.90
SCHEMBL6984150 0.79
SCHEMBL11162836 0.76 LCK (0.43) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL8913817 0.76 LCK (0.43) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL9395418 0.75 MAPT (0.46) LCKPPARDZDHHC20ZDHHC2MAPT
SCHEMBL9395704 0.75 MAPT (0.46) LCKPPARDZDHHC20ZDHHC2MAPT
SCHEMBL10477215 0.75 MAPT (0.46) LCKPPARDZDHHC20ZDHHC2MAPT
SCHEMBL5177435 0.75 MAPT (0.46) LCKPPARDZDHHC20ZDHHC2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101591266-B (3R)-[(2-halo-1-oxooctyl)oxy] tridecyl cyanide and preparation method and application thereof SHANGHAI INST PHARM INDUSTRY 2013-05-29 CN disclosed
CN-101591266-A (3R)-[(2-halo-1-oxo octyl group) oxygen base] tridecyl cyanide and its production and application SHANGHAI INST PHARM INDUSTRY (CN) 2009-12-02 CN disclosed
US-4487781-A HEAT RESISTANCE; PHOTOSTABILITY SANKYO COMPANY LIMITED (JP) 1984-12-11 US disclosed
US-4259350-A PROTECTING DEGRADABLE ORGANIC MATERIAL FROM FUNGAL OR INSECT ATTACK SANKYO COMPANY LIMITED (JP) 1981-03-31 US disclosed