SCHEMBL13622632

SCHEMBL13622632

Cc1ccc(N2CCC(CC(=O)O)CC2)nn1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
DGAT1 O75907 1/20 0.44
HSD11B1 P28845 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FFAR4 Q5NUL3 13/20 0.42
PDE4B Q07343 1/20 0.40

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 SCHEMBL4354307 0.92 FFAR4 (0.46) LMNAHTTDGAT1HSD11B1MEN1
SCHEMBL20038408 0.84 LMNA (0.46) LMNAHTTDGAT1HSD11B1MEN1
SCHEMBL20249464 0.83 LMNA (0.43) LMNAHTTDGAT1HSD11B1MEN1
SCHEMBL1728825 0.83 CKS1B (0.47) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL9195108 0.81 PDE10A (0.44) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL1728820 0.81 SCD (0.49) LMNAHTT
SCHEMBL1439618 0.80 LMNA (0.70) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL25059012 0.80 SMN1; SMN2 (0.41) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL1562375 0.79 MAPT (0.43) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL4354310 0.79 MEN1 (0.40) LMNAHTTDGAT1MEN1KMT2A

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 5 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-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
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 LMNA 4393/4885HTT 2476/4885DGAT1 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.