SCHEMBL17523866

SCHEMBL17523866

CC(C)CCCC[C@H](CO)CCC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
ALDH1A1 P00352 1/20 0.35
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.32
RIPK1 Q13546 1/20 0.31
PTPN2 P17706 1/20 0.30
PTPN1 P18031 1/20 0.30
CDC25B P30305 1/20 0.30

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
SCHEMBL17523865 1.00 LMNA (0.45) LMNAALDH1A1MEN1CYP3A4ALOX15
SCHEMBL17523947 0.98 LMNA (0.48) LMNAALDH1A1MEN1CYP3A4ALOX15
SCHEMBL17523949 0.98 LMNA (0.48) LMNAALDH1A1MEN1CYP3A4ALOX15
SCHEMBL17523805 0.96 LMNA (0.40) LMNAALDH1A1MEN1CYP3A4ALOX15
SCHEMBL17523804 0.96 LMNA (0.40) LMNAALDH1A1MEN1CYP3A4ALOX15
SCHEMBL25371761 0.87 TSHR (0.35) LMNAALDH1A1TSHRRIPK1
SCHEMBL17523871 0.85 LMNA (0.46) LMNAALDH1A1RIPK1
SCHEMBL17523869 0.85 LMNA (0.46) LMNAALDH1A1RIPK1
SCHEMBL17523867 0.83 LMNA (0.68) LMNAALDH1A1CYP3A4
SCHEMBL17523950 0.83 LMNA (0.50) LMNAALDH1A1MEN1KMT2ATSHR

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 3497/4885ALDH1A1 2376/4885MEN1 786/4885

“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.