SCHEMBL17523969

SCHEMBL17523969

CCN1CCN(CCCCC[C@@H](CO)CCC(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
GNAO1 P09471 2/20 0.33
GNAI3 P08754 1/20 0.33
GNAI1 P63096 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.31
PAOX Q6QHF9 1/20 0.31
KCNH2 Q12809 2/20 0.31
PKM P14618 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
SCHEMBL17523979 1.00 LMNA (0.41) LMNAGNAO1GNAI3GNAI1ALDH1A1
SCHEMBL17523885 0.98 LMNA (0.38) LMNAGNAO1GNAI3GNAI1ALDH1A1
SCHEMBL17523886 0.98 LMNA (0.38) LMNAGNAO1GNAI3GNAI1ALDH1A1
SCHEMBL15183540 0.94 LMNA (0.35) LMNAALDH1A1KDM4EUSP2
SCHEMBL15183543 0.94 LMNA (0.35) LMNAALDH1A1KDM4EUSP2
SCHEMBL17523967 0.90 PAOX (0.41) LMNAGNAO1GNAI3GNAI1ALDH1A1
SCHEMBL17523968 0.90 PAOX (0.41) LMNAGNAO1GNAI3GNAI1ALDH1A1
SCHEMBL17524195 0.88 GNAO1 (0.34) LMNAGNAO1GNAI3GNAI1ALDH1A1
SCHEMBL17523903 0.88 CHRM4 (0.39) LMNAALDH1A1KDM4EUSP2PAOX
SCHEMBL17524196 0.88 GNAO1 (0.34) LMNAGNAO1GNAI3GNAI1ALDH1A1

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 3497/4885GNAO1 4461/4885GNAI3 2852/4885

“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.