SCHEMBL17523920

SCHEMBL17523920

CCCCCC[C@@H](O)CCCC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.53
FFAR4 Q5NUL3 1/20 0.53
GPR84 Q9NQS5 8/20 0.50
ACACB O00763 1/20 0.48
ACACA Q13085 1/20 0.48
NFKB1 P19838 1/20 0.47
FDPS P14324 3/20 0.43
SPHK1 Q9NYA1 1/20 0.43
FAAH O00519 1/20 0.43
PSMD14 O00487 2/20 0.43
PLA2G1B P04054 2/20 0.43
MMP2 P08253 2/20 0.43
ATG4B Q9Y4P1 2/20 0.43
HSP90AA1 P07900 1/20 0.43
RAD52 P43351 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
SCHEMBL8895497 1.00 FFAR1 (0.53) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL29229895 1.00 FFAR1 (0.53) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL17523919 1.00 FFAR1 (0.53) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL8897109 0.98 FFAR1 (0.52) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL8895607 0.98 FFAR1 (0.52) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL17523845 0.98 FFAR4 (0.50) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL17523843 0.98 FFAR4 (0.50) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL8897886 0.93 FFAR1 (0.52) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL8897199 0.93 ACACB (0.52) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL30483471 0.93 ACACB (0.52) FFAR1FFAR4GPR84ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160039879-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. (US) 2016-02-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160039879-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF FKBP1B, MALT1, FKBP5 FFAR1 2686/4885FFAR4 2413/4885GPR84 3935/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.