SCHEMBL2564097

SCHEMBL2564097

N#CCCC(=O)NCCBr

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.48
HSD17B10 Q99714 1/20 0.46
MAPT P10636 1/20 0.45
MCL1 Q07820 3/20 0.39
ALDH1A1 P00352 1/20 0.32
CASP2 P42575 1/20 0.31
TSHR P16473 1/20 0.31
SELP P16109 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
SCHEMBL2566414 0.80 MAPT (0.54) FAAHHSD17B10MAPTMCL1CASP2
SCHEMBL19384446 0.79 MAPT (0.45) HSD17B10MAPTMCL1ALDH1A1CASP2
SCHEMBL2565255 0.79 MAPT (0.49) FAAHHSD17B10MAPTMCL1TSHR
SCHEMBL28356920 0.77
SCHEMBL8108657 0.74
SCHEMBL20263728 0.74 MAPT (0.56) FAAHHSD17B10MAPTMCL1CASP2
SCHEMBL16182005 0.74
SCHEMBL20263717 0.74 MAPT (0.56) FAAHHSD17B10MAPTMCL1CASP2
SCHEMBL8771608 0.74
SCHEMBL10960666 0.72 FAAH (0.41) FAAHHSD17B10MAPTMCL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382218-A1 DELTA-5-DESATURASE INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2011-11-02 EP disclosed
WO-2010087467-A1 DELTA-5-DESATURASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-05 WO disclosed
US-20100190747-A1 Fused ring compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-07-29 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-20100190747-A1 Fused ring compound and use thereof CYP46A1, LTB4R2, PTGES FAAH 585/4885HSD17B10 105/4885MAPT 2366/4885

“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.