SCHEMBL4932064

SCHEMBL4932064

Cc1cc2nc(CCC(N)C(=O)NO)n(-c3ccccc3)c2cc1C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 2/20 0.44
▸ NTRK2 Q16620 2/20 0.44
▸ POLB P06746 1/20 0.43
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PDE10A Q9Y233 8/20 0.39
▸ HSD17B10 Q99714 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ TP53 P04637 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
SCHEMBL4932046 1.00 NTRK1 (0.44) NTRK1NTRK2POLBMEN1KMT2A
SCHEMBL4933134 1.00 NTRK1 (0.44) NTRK1NTRK2POLBMEN1KMT2A
SCHEMBL4935414 0.91 NTRK1 (0.41) NTRK1NTRK2POLBMEN1KMT2A
SCHEMBL4936237 0.91 NTRK1 (0.41) NTRK1NTRK2POLBMEN1KMT2A
SCHEMBL4935437 0.91 NTRK1 (0.41) NTRK1NTRK2POLBMEN1KMT2A
SCHEMBL4934374 0.89 HDAC6 (0.37) NTRK1NTRK2POLBMEN1KMT2A
SCHEMBL4934387 0.89 HDAC6 (0.37) NTRK1NTRK2POLBMEN1KMT2A
SCHEMBL4930341 0.88 MAPT (0.40) NTRK1NTRK2POLBPDE10AHSD17B10
SCHEMBL4930357 0.88 MAPT (0.40) NTRK1NTRK2POLBPDE10AHSD17B10
SCHEMBL4931996 0.88 KDM4E (0.41) MEN1KMT2APDE10AHSD17B10NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080132539-A1 Hydroxamic Acid Derivative And Age Generation Inhibitor Containing The Derivative KUREHA CORPORATION (JP) 2008-06-05 — — US disclosed
EP-1707560-A1 HYDROXAMIC ACID DERIVATIVE AND AGE GENERATION INHIBITOR CONTAINING THE DERIVATIVE Kureha Corporation (JP) 2006-10-04 — — EP 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-20080132539-A1 Hydroxamic Acid Derivative And Age Generation Inhibitor Containing The Derivative HDAC5, HDAC1, HDAC9 NTRK1 4781/4885NTRK2 4153/4885POLB 633/4885

“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.

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