SCHEMBL8572016

SCHEMBL8572016

CCCCCC[C@@H](Br)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 1/20 1.00
▸ PPARD Q03181 1/20 1.00
▸ ZDHHC20 Q5W0Z9 1/20 1.00
▸ ZDHHC2 Q9UIJ5 1/20 1.00
▸ ZDHHC7 Q9NXF8 2/20 0.62
▸ GPR84 Q9NQS5 7/20 0.59
▸ FFAR1 O14842 2/20 0.59
▸ MAPT P10636 1/20 0.57
▸ ACE2 Q9BYF1 1/20 0.53
▸ GRIK1 P39086 2/20 0.48
▸ GRIK2 Q13002 2/20 0.48
▸ FFAR4 Q5NUL3 1/20 0.48
▸ SLC1A2 P43004 1/20 0.46
▸ SLC1A1 P43005 1/20 0.46

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
SCHEMBL10595854 1.00 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL11595308 1.00 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL9096771 1.00 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL817063 1.00 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL3954970 1.00 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL3954525 1.00 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL23829555 1.00 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL337934 1.00 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL2718855 1.00 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL2721068 1.00 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210289794-A1 COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-09-23 — — US disclosed
US-5852212-A Process for preparation of optically active α-bromo and α-chlorocarboxylic compounds ROLIC AG (CH) 1998-12-22 — — US disclosed
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