SCHEMBL8490442

SCHEMBL8490442

CCCCCCCCCCCCCCC(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.46
CA2 P00918 2/20 0.44
SMPD1 P17405 3/20 0.43
GPR84 Q9NQS5 7/20 0.42
FFAR1 O14842 1/20 0.42
MAPT P10636 1/20 0.41
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
FAAH O00519 1/20 0.40
CA1 P00915 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
GRIK1 P39086 1/20 0.40
GRIK2 Q13002 1/20 0.40

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
SCHEMBL17377641 1.00 ZDHHC7 (0.46) ZDHHC7CA2SMPD1GPR84FFAR1
SCHEMBL9659247 0.93 TDP1 (0.42) ZDHHC7CA2SMPD1GPR84FFAR1
SCHEMBL29284270 0.93 ZDHHC7 (0.53) ZDHHC7CA2SMPD1GPR84FFAR1
SCHEMBL7100720 0.93 GPR84 (0.48) ZDHHC7CA2GPR84FFAR1MAPT
SCHEMBL28766383 0.93 GPR84 (0.48) ZDHHC7CA2GPR84FFAR1MAPT
SCHEMBL9659765 0.93 GPR84 (0.48) ZDHHC7CA2GPR84FFAR1MAPT
SCHEMBL27833152 0.93 GPR84 (0.48) ZDHHC7CA2GPR84FFAR1MAPT
SCHEMBL28994389 0.93 GPR84 (0.48) ZDHHC7CA2GPR84FFAR1MAPT
SCHEMBL28657458 0.93 GPR84 (0.48) ZDHHC7CA2GPR84FFAR1MAPT
SCHEMBL7804077 0.92 CA2 (0.47) CA2CA1

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-5965524-A BIOSURFACTANTS, ANTIBACTERIAL, ANTIVIRAL AND ANTITRYPANOSOMAL THERAPEUTIC COMPOUNDS PEPTIDE TECHNOLOGIES CORPORATION (US) 1999-10-12 US disclosed
US-5169862-A Bactericides, viricides, antiprotozoa agents PEPTIDE TECHNOLOGIES CORPORATION (US) 1992-12-08 US disclosed