SCHEMBL13634101

SCHEMBL13634101

Cc1cnc2nc1Nc1ccc(NC(=O)Cc3noc4ccccc34)c(c1)CCc1cccc(c1)N2

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.49
RAB9A P51151 5/20 0.44
NPC1 O15118 4/20 0.44
HPGD P15428 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 3/20 0.43
TP53 P04637 3/20 0.43
KDM4E B2RXH2 2/20 0.42
JAK2 O60674 1/20 0.41
MAPT P10636 4/20 0.41
ALK Q9UM73 2/20 0.40
POLB P06746 2/20 0.39
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL1073781 0.91 ALK (0.49) SMN1; SMN2RAB9ANPC1HPGDNPSR1
Trifluoroacetic Acid SCHEMBL4360587 0.87 ALK (0.45) SMN1; SMN2RAB9ANPC1HPGDNPSR1
SCHEMBL13634102 0.87 JAK2 (0.41) SMN1; SMN2NPC1HPGDNPSR1LMNA
SCHEMBL13633236 0.83 ALK (0.42) JAK2ALK
SCHEMBL13633131 0.83 ALK (0.43) JAK2ALK
SCHEMBL13633063 0.83 ALK (0.41) HPGDKDM4EJAK2MAPTALK
SCHEMBL13634016 0.82 JAK2 (0.43) RAB9ANPC1NPSR1JAK2MAPT
SCHEMBL13633235 0.82 ALK (0.44) SMN1; SMN2RAB9ANPC1HPGDLMNA
SCHEMBL13633078 0.82 ALK (0.40) SMN1; SMN2TP53JAK2MAPTALK
SCHEMBL13633079 0.82 ALK (0.44) JAK2ALK

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 SMN1; SMN2 4274/4885RAB9A 1998/4885NPC1 2849/4885

“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.