SCHEMBL13951960

SCHEMBL13951960

CC(O)[C@@H](CO)OCn1cnc2c(N(C(=O)c3ccc(CNC(=O)OCC4c5ccccc5-c5ccccc54)cc3)C(=O)c3ccc(CNC(=O)OCC4c5ccccc5-c5ccccc54)cc3)ncnc21

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.36
▸ DOT1L Q8TEK3 1/20 0.35
▸ IARS1 P41252 1/20 0.34
▸ MARS1 P56192 2/20 0.33
▸ ADORA1 P30542 1/20 0.32
▸ KMT2A Q03164 2/20 0.31
▸ CTSK P43235 1/20 0.31
▸ RAB9A P51151 1/20 0.30

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
SCHEMBL16417879 0.79 LMNA (0.32) LMNADOT1L
SCHEMBL13375777 0.77 SLC29A1 (0.46) LMNAADORA1
SCHEMBL13930530 0.77 SLC29A1 (0.46) LMNAADORA1
SCHEMBL13897557 0.75 HDAC1 (0.38) IARS1MARS1ADORA1
SCHEMBL13951961 0.71 KMT2A (0.40) LMNAKMT2ACTSK
SCHEMBL13897698 0.70 CTSK (0.36) KMT2ACTSK
SCHEMBL16417876 0.68 CDK5 (0.35) DOT1LIARS1ADORA1CTSK
SCHEMBL13952071 0.68 CDK5 (0.35) DOT1LADORA1CTSK
SCHEMBL16256784 0.67 KMT2A (0.49) KMT2A
SCHEMBL16256817 0.66 KMT2A (0.52) LMNAKMT2A

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-20090053710-A1 FUNCTIONAL MOLECULE, FUNCTIONAL MOLECULE SYNTHESIZING AMIDITE AND TARGET SUBSTANCE ANALYSIS METHOD FUJITSU LIMITED (JP) 2009-02-26 — — 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-20090053710-A1 FUNCTIONAL MOLECULE, FUNCTIONAL MOLECULE SYNTHESIZING AMIDITE AND TARGET SUBSTANCE ANALYSIS METHOD TACR1, TACR2, ATIC LMNA 2138/4885DOT1L 4426/4885IARS1 3746/4885

“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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