SCHEMBL4364982

SCHEMBL4364982

N#Cc1ccc(N2CCC(CC(=O)OC(=O)C(F)(F)F)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.46
FFAR4 Q5NUL3 2/20 0.45
DPP4 P27487 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
KDM4E B2RXH2 1/20 0.42
TP53 P04637 1/20 0.42
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
LCAT P04180 1/20 0.39
CHRM2 P08172 2/20 0.38
TNF P01375 1/20 0.38
NOD1 Q9Y239 1/20 0.38
CHRM1 P11229 1/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
F10 P00742 1/20 0.38

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
SCHEMBL1024922 0.84 CHRM2 (0.46) CHRM4FFAR4CHRM2CHRM1
SCHEMBL1025208 0.84 CHRM4 (0.51) CHRM4DPP4LCATCHRM2CHRM1
Trifluoroacetic Acid SCHEMBL1026186 0.82 FFAR4 (0.54) CHRM4FFAR4DPP4SIGMAR1KDM4E
SCHEMBL1025273 0.82 ITGB3 (0.45) DPP4CYP3A4F10
SCHEMBL4359941 0.81 CHRM4 (0.51) CHRM4FFAR4LCAT
SCHEMBL4355886 0.81 CHRM4 (0.48) CHRM4FFAR4CYP3A4
SCHEMBL7753345 0.80 USP14 (0.52) CHRM4FFAR4DPP4SIGMAR1KDM4E
SCHEMBL7753402 0.79 FFAR4 (0.52) CHRM4FFAR4DPP4SIGMAR1KDM4E
SCHEMBL1026187 0.77 KDM4E (0.43) CHRM4FFAR4DPP4KDM4ETP53
SCHEMBL1024488 0.77 KDM4E (0.53) CHRM4FFAR4DPP4KDM4E

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-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK CHRM4 4834/4885FFAR4 2075/4885DPP4 1423/4885

“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.