SCHEMBL6135025

SCHEMBL6135025

O=C(ON1CCC(OCC2CCCCC2)CC1)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSK P43235 1/20 0.40
EPHX2 P34913 1/20 0.37
LPL P06858 1/20 0.36
LIPG Q9Y5X9 1/20 0.36
LMNA P02545 1/20 0.33
GPR119 Q8TDV5 5/20 0.32
SLC1A3 P43003 2/20 0.31
SLC1A2 P43004 2/20 0.31
SLC1A1 P43005 2/20 0.31
HCRTR2 O43614 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MLYCD O95822 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL21590696 0.80 LIPG (0.40) CTSLCTSBCTSKLPLLIPG
SCHEMBL6134246 0.78 POLB (0.32) LIPGHCRTR2
SCHEMBL6135635 0.76 MLNR (0.36) LIPG
SCHEMBL5560105 0.75 ENPP2 (0.32)
SCHEMBL23466734 0.75 LIPG (0.40) LIPG
SCHEMBL6134978 0.73 LIPG (0.43) EPHX2LIPGLMNA
SCHEMBL6134660 0.73 CTSL (0.45) CTSLCTSBCTSKEPHX2LMNA
SCHEMBL980149 0.73 MLYCD (0.32) EPHX2ALDH1A1MLYCD
SCHEMBL25246960 0.73 CFTR (0.31)
SCHEMBL2912964 0.73 KCNQ3 (0.32) LMNAALDH1A1

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-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 CTSL 222/4885CTSB 1244/4885CTSK 2651/4885

“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.