SCHEMBL10166430

SCHEMBL10166430

CC1CCCN(C2CCN(C(=O)c3ccc(Nc4ccc(-c5ccc6c(c5)CNCO6)n5ccnc45)cc3)CC2)C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 16/20 0.40
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
L3MBTL3 Q96JM7 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.35
IKBKB O14920 1/20 0.35
CHUK O15111 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.35
PRKCZ Q05513 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
IKBKG Q9Y6K9 1/20 0.35
GRM5 P41594 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
SCHEMBL10166412 0.93 L3MBTL3 (0.37) JAK2JAK1L3MBTL3L3MBTL1MEN1
SCHEMBL10166356 0.92 L3MBTL3 (0.42) L3MBTL3L3MBTL1MEN1IKBKBCHUK
SCHEMBL10166351 0.86 MAPKAPK5 (0.43) JAK2JAK1
SCHEMBL1794356 0.86 MAPKAPK5 (0.44) ADRA1AJAK2JAK1
SCHEMBL10166425 0.86 ALDH1A1 (0.41) L3MBTL1MEN1KMT2A
SCHEMBL10166405 0.85 IKBKB (0.38) JAK2JAK1IKBKBCHUKIKBKG
SCHEMBL10166161 0.83 CDK6 (0.37)
SCHEMBL10166437 0.83 CCND1 (0.37)
SCHEMBL10166841 0.83 VNN1 (0.39) JAK2IKBKBCHUKIKBKG
SCHEMBL10165790 0.81 MAPKAPK2 (0.35)

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-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N. V. (BE) 2012-01-12 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-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES COL2A1, MMP1, COL1A1 ADRA1A 2676/4885JAK2 1510/4885JAK1 1529/4885

“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.