SCHEMBL4357415

SCHEMBL4357415

O=C(Nc1ccc2cc1CCc1cccc(c1)Nc1ncc(Cl)c(n1)N2)C1CCCN(C(=O)Nc2ccccc2)C1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 6/20 0.49
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 1/20 0.41
RHOA P61586 1/20 0.39
JAK2 O60674 5/20 0.38
JAK1 P23458 5/20 0.38
TYK2 P29597 5/20 0.38
JAK3 P52333 5/20 0.38
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
TP53BP1 Q12888 1/20 0.37

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 SCHEMBL4358813 0.96 ALK (0.46) ALKKMT2ASMN1; SMN2TSHRRHOA
SCHEMBL1075119 0.96 ALK (0.51) ALKKMT2ASMN1; SMN2TSHRJAK2
Trifluoroacetic Acid SCHEMBL4358083 0.92 ALK (0.47) ALKKMT2ASMN1; SMN2JAK2JAK1
SCHEMBL1075366 0.92 ALK (0.52) ALKJAK2JAK1TYK2JAK3
SCHEMBL1075923 0.91 ALK (0.50) ALKSMN1; SMN2RHOAJAK2JAK1
SCHEMBL4363395 0.90 ALK (0.49) ALKJAK2JAK1TYK2JAK3
SCHEMBL4364967 0.90 ALK (0.51) ALKSMN1; SMN2JAK2JAK1TYK2
SCHEMBL4362936 0.90 ALK (0.54) ALKJAK2JAK1TYK2JAK3
SCHEMBL4358516 0.89 ALK (0.48) ALKJAK2JAK1TYK2JAK3
SCHEMBL4360802 0.89 ALK (0.48) ALKJAK2JAK1TYK2JAK3

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 6 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 claimed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US claimed
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

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 3/4885KMT2A 382/4885SMN1; SMN2 4274/4885

“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.