SCHEMBL1025565

SCHEMBL1025565

Cc1cc(N2CCC(CC(=O)OC(=O)C(F)(F)F)CC2)no1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.36
KLK7 P49862 4/20 0.35
DGAT1 O75907 1/20 0.35
ALDH1A1 P00352 3/20 0.34
FFAR4 Q5NUL3 5/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ACACB O00763 1/20 0.33
TSHR P16473 1/20 0.33
MITF O75030 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33

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
Trifluoroacetic Acid SCHEMBL1025564 0.83 FFAR4 (0.44) FFAR4
SCHEMBL4354310 0.80 MEN1 (0.40) SCDDGAT1ALDH1A1SMN1; SMN2TSHR
SCHEMBL13622722 0.80 FFAR4 (0.43) FFAR4
SCHEMBL4365334 0.79 CHRM4 (0.48) FFAR4HTT
SCHEMBL1025769 0.78 SCD (0.41) SCDKLK7ALDH1A1SMN1; SMN2ACACB
Acetic Acid SCHEMBL1025767 0.77 SCD (0.44) SCDALDH1A1ACACBTSHR
SCHEMBL4364569 0.77 LSS (0.43) DGAT1FFAR4
SCHEMBL1023389 0.75 KDM4E (0.50) ALDH1A1
SCHEMBL1024330 0.75 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2TSHR
SCHEMBL1025550 0.74 FFAR1 (0.44) DGAT1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
EP-2274288-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS Incyte Corporation (US) 2011-01-19 EP disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
WO-2009132202-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-10-29 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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK SCD 2919/4885KLK7 3790/4885DGAT1 2411/4885

“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.