SCHEMBL4357617

SCHEMBL4357617

N#Cc1ccc(C(F)(F)F)cc1N1CCC(CC(=O)OC(=O)C(F)(F)F)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 10/20 0.48
FFAR1 O14842 2/20 0.48
CHRM4 P08173 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
RXFP1 Q9HBX9 2/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
KDM4E B2RXH2 1/20 0.40
LPL P06858 1/20 0.40
LIPG Q9Y5X9 1/20 0.40
FFAR2 O15552 1/20 0.39
EIF4EBP1 Q13541 1/20 0.39
LDHA P00338 1/20 0.39
LMNA P02545 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
SCHEMBL4355886 0.86 CHRM4 (0.48) FFAR4FFAR1CHRM4
SCHEMBL13622685 0.85 FFAR4 (0.59) FFAR4FFAR1CHRM4SMN1; SMN2KDM4E
Trifluoroacetic Acid SCHEMBL4357612 0.84 FFAR4 (0.59) FFAR4FFAR1CHRM4EIF4EBP1
SCHEMBL5800096 0.78 FFAR2 (0.54) FFAR4FFAR1CHRM4SMN1; SMN2RXFP1
SCHEMBL2527850 0.78 SMN1; SMN2 (0.46) FFAR4FFAR1CHRM4SMN1; SMN2RXFP1
SCHEMBL1025467 0.78 HRH4 (0.43) FFAR4FFAR1SMN1; SMN2MAPTKDM4E
SCHEMBL4359206 0.78 DPP4 (0.43) FFAR4FFAR1CHRM4KDM4E
SCHEMBL1024488 0.76 KDM4E (0.53) FFAR4FFAR1CHRM4KDM4E
SCHEMBL4364982 0.76 CHRM4 (0.46) FFAR4CHRM4TP53KDM4E
SCHEMBL1026537 0.76 GAA (0.41) FFAR4FFAR1CHRM4KDM4E

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 FFAR4 2075/4885FFAR1 1611/4885CHRM4 4834/4885

“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.