SCHEMBL8937087

SCHEMBL8937087

CCCCCCCCC(Br)C(C)=O

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.69
PPARD Q03181 1/20 0.69
ZDHHC20 Q5W0Z9 1/20 0.69
ZDHHC2 Q9UIJ5 1/20 0.69
ZDHHC7 Q9NXF8 2/20 0.62
FAAH O00519 1/20 0.53
GPR84 Q9NQS5 7/20 0.48
FFAR1 O14842 2/20 0.48
MAPT P10636 1/20 0.47
CA2 P00918 1/20 0.45
FFAR4 Q5NUL3 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
FDPS P14324 1/20 0.43

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
SCHEMBL25477762 1.00 LCK (0.69) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL11967104 1.00 LCK (0.69) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL29597202 1.00 LCK (0.69) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL8937075 0.98 LCK (0.65) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL5615305 0.91
SCHEMBL10595854 0.82 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL375050 0.82 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL3790420 0.82 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL337479 0.82 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL2721068 0.82 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-54119408-A None JP disclosed
US-5536808-A Thiazole polymers and method of producing same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1996-07-16 US disclosed
US-5342937-A Extraction of metals especially gallium ZENECA, LIMITED (GB) 1994-08-30 US disclosed
US-5074911-A Extracting metal values from aqueous solution with immiscible solvent and dissolved heterocyclic thione IMPERICAL CHEMICAL INDUSTRIES PLC (GB) 1991-12-24 US disclosed
EP-0408203-A2 Heterocyclic thione ZENECA LIMITED (GB) 1991-01-16 EP disclosed
JP-S54119408-A DERIVATIVE OF SUBSTITUTED ALKYL METHYL KETONE SAGAMI CHEM RES CENTER 1979-09-17 JP disclosed