SCHEMBL5873067

SCHEMBL5873067

Cc1cc(C)c2[nH]nc(-c3nc(C(=O)N4CCNCC4)c(-c4cccnc4)s3)c2c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.43
MKNK2 Q9HBH9 1/20 0.43
PIM1 P11309 7/20 0.38
PIM3 Q86V86 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
PTK6 Q13882 1/20 0.37
MAP2K4 P45985 1/20 0.37
KDM5A P29375 1/20 0.37
HTT P42858 2/20 0.35
NAMPT P43490 1/20 0.35
LRRK2 Q5S007 1/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTR2C P28335 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
HRH4 Q9H3N8 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
SCHEMBL5873110 0.92 MKNK1 (0.42) MKNK1MKNK2PIM1PIM3PIM2
SCHEMBL5769525 0.92 PIM1 (0.41) PIM1MAP2K4HTTNAMPTMEN1
SCHEMBL5872872 0.90 MKNK1 (0.45) MKNK1MKNK2PIM1PIM3PIM2
SCHEMBL5872886 0.90 NAMPT (0.39) PIM1MAP2K4KDM5AHTTNAMPT
SCHEMBL5872965 0.89 KMT2A (0.43) PIM1MAP2K4HTTNAMPTMEN1
SCHEMBL5872806 0.88 DYRK1A (0.41) PIM1MAP2K4KDM5A
SCHEMBL5873193 0.88 DYRK1A (0.41) PIM1MAP2K4HTTNAMPTKDM4E
SCHEMBL5873155 0.87 SLC6A7 (0.42) PIM1HTTKDM4EMEN1ALDH1A1
SCHEMBL5873066 0.87 MEN1 (0.42) KDM4EMEN1ALDH1A1KMT2A
SCHEMBL5872868 0.87 CYP2C9 (0.40) PIM1KDM5AHTTL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6984652-B2 Gyrase inhibitors WARNER-LAMBERT COMPANY LLC (US) 2006-01-10 US disclosed
US-20050250823-A1 Gyrase inhibitors YAGER KRAIG 2005-11-10 US disclosed
US-20050054697-A1 Gyrase inhibitors PFIZER INC. 2005-03-10 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 (2 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-20050054697-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B MKNK1 2151/4885MKNK2 2127/4885PIM1 1909/4885
US-20050250823-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B MKNK1 2151/4885MKNK2 2127/4885PIM1 1909/4885

“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.