SCHEMBL4267075

SCHEMBL4267075

CNC(=O)c1cncc(C(N)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 2/20 0.49
MKNK2 Q9HBH9 2/20 0.49
SIRT2 Q8IXJ6 4/20 0.47
SIRT1 Q96EB6 4/20 0.47
SIRT3 Q9NTG7 4/20 0.47
RAF1 P04049 5/20 0.47
KDM4E B2RXH2 2/20 0.44
CYP11B2 P19099 1/20 0.44
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
PLAU P00749 1/20 0.42
PKMYT1 Q99640 1/20 0.42
ALDH1A1 P00352 1/20 0.42
PTGS2 P35354 1/20 0.41
F7 P08709 1/20 0.41
F3 P13726 1/20 0.41
SARM1 Q6SZW1 1/20 0.41
SIRT6 Q8N6T7 1/20 0.41
SIRT5 Q9NXA8 1/20 0.41
SIRT4 Q9Y6E7 1/20 0.41

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
SCHEMBL5909485 0.90 RAF1 (0.53) MKNK1MKNK2RAF1KDM4EHDAC8
SCHEMBL3829749 0.85 RAF1 (0.44) MKNK1MKNK2SIRT2SIRT1SIRT3
SCHEMBL2841794 0.83 SIRT2 (0.54) MKNK1MKNK2SIRT2SIRT1SIRT3
SCHEMBL21607970 0.82 RAF1 (0.48) MKNK1MKNK2RAF1KDM4ECYP11B2
SCHEMBL3934325 0.81 KDM4E (0.60) MKNK1MKNK2RAF1KDM4ECYP11B2
SCHEMBL3168799 0.78 KDM4E (0.59) MKNK1MKNK2RAF1KDM4EALDH1A1
SCHEMBL10274534 0.78 HCAR2 (0.62) MKNK1MKNK2RAF1KDM4EALDH1A1
SCHEMBL4267083 0.78 SMYD3 (0.47) MKNK1MKNK2SIRT2SIRT1SIRT3
SCHEMBL4477190 0.78 MKNK1 (0.66) MKNK1MKNK2SIRT2SIRT1SIRT3
SCHEMBL29224909 0.78 RAF1 (0.46) MKNK1MKNK2SIRT2SIRT1SIRT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2285783-B1 INDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2014-05-21 EP disclosed
US-8263597-B2 Indazole compounds as CCR1 receptor antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-09-11 US disclosed
US-20110294808-A1 Indazole Compounds As CCR1 Receptor Antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-01 US disclosed
WO-2009134666-A1 INDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-11-05 WO 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-20110294808-A1 Indazole Compounds As CCR1 Receptor Antagonists CCR1, CCR3, CCRL2 MKNK1 926/4885MKNK2 1042/4885SIRT2 2431/4885

“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.