SCHEMBL16493418

SCHEMBL16493418

COC(=O)c1c(C)n([C@H](C)C2CCN(C(=O)C(C)(F)F)CC2)c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 20/20 0.50
▸ KCNH2 Q12809 1/20 0.49
▸ EZH1 Q92800 1/20 0.49

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
SCHEMBL16486463 0.90 EZH2 (0.47) EZH2KCNH2EZH1
SCHEMBL16486315 0.87 EZH2 (0.51) EZH2KCNH2EZH1
SCHEMBL18698692 0.87 EZH2 (0.51) EZH2KCNH2EZH1
SCHEMBL16486313 0.87 EZH2 (0.51) EZH2KCNH2EZH1
SCHEMBL16376965 0.87 EZH2 (0.51) EZH2KCNH2EZH1
SCHEMBL17880820 0.86 EZH2 (0.43) EZH2KCNH2EZH1
SCHEMBL16486389 0.86 EZH2 (0.65) EZH2KCNH2EZH1
SCHEMBL16486390 0.86 EZH2 (0.65) EZH2KCNH2EZH1
SCHEMBL16486460 0.86 EZH2 (0.62) EZH2KCNH2EZH1
SCHEMBL16486459 0.86 EZH2 (0.62) EZH2KCNH2EZH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9969716-B2 Indole derivatives as modulators of methyl modifying enzymes, compositions and uses thereof CONSTELLATION PHARMACEUTICALS, INC. (US) 2018-05-15 — — US disclosed
US-20160185757-A1 INDOLE DERIVATIVES AS MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF CONSTELLATION PHARMACEUTICALS, INC. (US) 2016-06-30 — — US disclosed
WO-2015023915-A1 INDOLE DERIVATIVES AS MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF CONSTELLATION PHARMACEUTICALS, INC. (US) 2015-02-19 — — 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-20160185757-A1 INDOLE DERIVATIVES AS MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF INMT, HNMT, NNMT EZH2 77/4885KCNH2 4394/4885EZH1 121/4885

“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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