SCHEMBL2938409

SCHEMBL2938409

COC[C@H]1CC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)[C@H](N(C(=O)O)C(C)(C)C)C1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.49
PYGL P06737 13/20 0.47
SMYD3 Q9H7B4 2/20 0.45
F10 P00742 3/20 0.44

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
SCHEMBL2941234 0.91 F10 (0.52) EHMT2PYGLSMYD3F10
SCHEMBL2939776 0.91 F10 (0.52) EHMT2PYGLSMYD3F10
SCHEMBL6362844 0.88 F10 (0.55) EHMT2PYGLSMYD3F10
SCHEMBL4364818 0.84 EHMT2 (0.55) EHMT2PYGLSMYD3F10
SCHEMBL4364823 0.84 EHMT2 (0.55) EHMT2PYGLSMYD3F10
SCHEMBL3101017 0.84 SMYD3 (0.49) EHMT2PYGLSMYD3F10
SCHEMBL12035480 0.83 EHMT2 (0.55) EHMT2PYGLSMYD3F10
SCHEMBL3109143 0.83 SMYD3 (0.52) EHMT2PYGLSMYD3F10
SCHEMBL3079242 0.83 SMYD3 (0.52) EHMT2PYGLSMYD3F10
SCHEMBL6361621 0.83 F10 (0.57) PYGLSMYD3F10

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-20100093785-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2010-04-15 US disclosed
US-20050119486-A1 Diamine derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2005-06-02 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-20100093785-A1 DIAMINE DERIVATIVES C9, C1S, C1R EHMT2 4179/4885PYGL 4049/4885SMYD3 3311/4885
US-20050119486-A1 Diamine derivatives C9, C1S, C1R EHMT2 4507/4885PYGL 3803/4885SMYD3 3513/4885

“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.