SCHEMBL5482387

SCHEMBL5482387

N#CC(CCO)(CCO)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.42
CETP P11597 11/20 0.41
ADORA1 P30542 2/20 0.39
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
FFAR1 O14842 1/20 0.36
ADORA2A P29274 1/20 0.35

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
SCHEMBL4874767 0.82 CASP1 (0.44) KIF11
SCHEMBL5476864 0.80 CTSK (0.41) ADORA1CTSSCTSK
SCHEMBL5476420 0.77 KCNN4 (0.41) KIF11ADORA1CTSK
SCHEMBL5475919 0.77 CYP4F2 (0.54)
SCHEMBL31306433 0.73 KIF11 (0.49) KIF11CETPFFAR1
SCHEMBL16136803 0.72 DRD2 (0.42)
SCHEMBL11204953 0.72 KAT6A (0.43) KIF11CETP
SCHEMBL688437 0.71 CETP (0.50) KIF11CETPCTSSCTSK
SCHEMBL688438 0.71 CETP (0.50) KIF11CETPCTSSCTSK
SCHEMBL11527555 0.70 KIF11 (0.51) KIF11CETP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070078120-A1 Novel piperidine derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-05 US disclosed
EP-1679069-A1 NOVEL PIPERIDINE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-07-12 EP 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-20070078120-A1 Novel piperidine derivative LDLR, PRMT5, MSR1 KIF11 4127/4885CETP 79/4885ADORA1 176/4885

“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.