SCHEMBL10021863

SCHEMBL10021863

C=Cc1cccc2cc(C(=O)OC3CN(COC)C(=O)N(COC)C3)ccc12

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 3/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
SIRT1 Q96EB6 1/20 0.32
SIRT3 Q9NTG7 1/20 0.32
SIRT5 Q9NXA8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
ACHE P22303 1/20 0.31
CYP2D6 P10635 1/20 0.31
LCK P06239 1/20 0.31

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
SCHEMBL10021864 0.93 ALDH1A1 (0.33) ALDH1A1KMT2AMEN1
SCHEMBL10021859 0.83 MEN1 (0.32) KDM2BALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL472300 0.82 CYP2D6 (0.33) KDM2BALDH1A1KMT2AMEN1CYP2D6
SCHEMBL10021858 0.81 ALDH1A1 (0.38) ALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL10021856 0.81 CYP2D6 (0.32) ALDH1A1KMT2AMEN1CYP2D6
SCHEMBL17936648 0.81 ALDH1A1 (0.44) ALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL10021861 0.80 ALDH1A1 (0.32) KDM2BALDH1A1KMT2AMEN1CYP2D6
SCHEMBL10021857 0.80 ALDH1A1 (0.32) KDM2BALDH1A1KMT2AMEN1CYP2D6
SCHEMBL10021860 0.79 MEN1 (0.36) ALDH1A1KMT2AMEN1
SCHEMBL471779 0.79 SMN1; SMN2 (0.38) ALDH1A1KMT2AMEN1L3MBTL1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2413192-B1 POLYMERIZABLE MONOMERS SHINETSU CHEMICAL CO (JP) 2016-12-21 EP disclosed
US-8501942-B2 Polymerizable monomers SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-08-06 US disclosed
US-8501942-B2 Polymerizable monomers SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-08-06 US disclosed
US-20120029193-A1 POLYMERIZABLE MONOMERS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-02-02 US disclosed
US-20120029193-A1 POLYMERIZABLE MONOMERS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-02-02 US disclosed
EP-2413192-A1 Polymerizable monomers Shin-Etsu Chemical Co., Ltd. (JP) 2012-02-01 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-20120029193-A1 POLYMERIZABLE MONOMERS C9, CCNA1, H1-0 KDM2B 3167/4885ALDH1A1 619/4885KMT2A 2389/4885

“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.