SCHEMBL17526403

SCHEMBL17526403

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

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
FFAR1 O14842 1/20 0.43
NFKB1 P19838 1/20 0.42
BLM P54132 1/20 0.41
FDPS P14324 1/20 0.41
GPR84 Q9NQS5 5/20 0.41
CA1 P00915 2/20 0.38
SPHK1 Q9NYA1 1/20 0.38
FAAH O00519 2/20 0.38
ALDH1A1 P00352 1/20 0.37
DNM1 Q05193 1/20 0.36

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
SCHEMBL7404028 1.00 LMNA (0.43) LMNAFFAR4FFAR1NFKB1BLM
SCHEMBL17526442 1.00 LMNA (0.43) LMNAFFAR4FFAR1NFKB1BLM
SCHEMBL17526455 0.95 FFAR4 (0.48) LMNAFFAR4FFAR1NFKB1FDPS
SCHEMBL17526456 0.95 FFAR4 (0.48) LMNAFFAR4FFAR1NFKB1FDPS
SCHEMBL31038971 0.95 FFAR4 (0.48) LMNAFFAR4FFAR1NFKB1FDPS
SCHEMBL17526524 0.92 FFAR1 (0.52) LMNAFFAR4FFAR1NFKB1FDPS
SCHEMBL8895795 0.92 FFAR1 (0.52) LMNAFFAR4FFAR1NFKB1FDPS
SCHEMBL17526436 0.92 FFAR1 (0.52) LMNAFFAR4FFAR1NFKB1FDPS
SCHEMBL11708323 0.92 FFAR4 (0.52) LMNAFFAR4FFAR1NFKB1FDPS
SCHEMBL3375891 0.90 FFAR1 (0.55) LMNAFFAR4FFAR1NFKB1FDPS

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 LMNA 3497/4885FFAR4 2413/4885FFAR1 2686/4885

“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.