SCHEMBL13634103

SCHEMBL13634103

Cc1cc(C(=O)N2CCC(C(=O)Nc3ccc4cc3CCc3cccc(c3)Nc3ncc(C)c(n3)N4)CC2)no1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 5/20 0.41
JAK2 O60674 2/20 0.39
GPR6 P46095 1/20 0.35
PABPC1 P11940 1/20 0.34
APOBEC3A P31941 1/20 0.34
EIF4H Q15056 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
HDAC6 Q9UBN7 1/20 0.33
CYP2D6 P10635 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
KMT2A Q03164 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL4360766 0.93 ALK (0.51) ALKJAK2
SCHEMBL13632936 0.92 ALK (0.40) ALKJAK2RAB9A
SCHEMBL4357170 0.90 ALK (0.40) ALKJAK2GPR6ALDH1A1TSHR
SCHEMBL4358636 0.89 ALK (0.49) ALKJAK2
Trifluoroacetic Acid SCHEMBL4363115 0.89 ALK (0.47) ALKJAK2L3MBTL1
SCHEMBL13633155 0.89 ALK (0.40) ALKJAK2PABPC1APOBEC3AEIF4H
SCHEMBL13633102 0.88 ALDH1A1 (0.44) ALKJAK2ALDH1A1L3MBTL1
SCHEMBL13633108 0.87 JAK2 (0.42) ALKJAK2ALDH1A1TSHRKMT2A
Trifluoroacetic Acid SCHEMBL1075811 0.86 ALK (0.37) ALKJAK2GPR6ALDH1A1TSHR
SCHEMBL13634042 0.85 ALK (0.43) ALKJAK2PABPC1APOBEC3AEIF4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 ALK 3/4885JAK2 1/4885GPR6 2491/4885

“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.