SCHEMBL6132550

SCHEMBL6132550

COCCCCCOC1CCN(OC(=O)C(F)(F)F)CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LSS P48449 2/20 0.36
LIPC P11150 2/20 0.34
LIPG Q9Y5X9 2/20 0.34
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 1/20 0.33
CES2 O00748 1/20 0.33
EPHX2 P34913 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
NAMPT P43490 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
SCHEMBL23466734 0.90 LIPG (0.40) LIPCLIPGCYP3A4
SCHEMBL6134978 0.86 LIPG (0.43) LSSLIPCLIPGCES2EPHX2
SCHEMBL6135635 0.82 MLNR (0.36) LIPCLIPGCES2
SCHEMBL6135131 0.82 LIPC (0.34) LSSLIPCLIPG
SCHEMBL6135437 0.82 CES2 (0.35) ALDH1A1CYP3A4CES2TSHR
SCHEMBL6134246 0.79 POLB (0.32) LIPG
SCHEMBL2912964 0.77 KCNQ3 (0.32) ALDH1A1KDM4E
SCHEMBL27658735 0.77 LIPC (0.36) LIPCLIPG
SCHEMBL21221365 0.76 LIPG (0.39) LIPCLIPGSMN1; SMN2KDM4EHPGD
SCHEMBL6132348 0.75 HPGD (0.46) ALDH1A1SMN1; SMN2KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6884774-B2 Cyclic hexapeptide derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-04-26 US disclosed
EP-1259535-B1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-04-13 EP disclosed
US-20030083238-A1 Cyclic hexapeptide derivatives ASTELLAS PHARMA INC. (JP) 2003-05-01 US disclosed
EP-1259535-A1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-27 EP disclosed
WO-2001060846-A1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-08-23 WO 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-20030083238-A1 Cyclic hexapeptide derivatives NGLY1, ALG1, CHIT1 LSS 251/4885LIPC 4424/4885LIPG 3333/4885

“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.