SCHEMBL21285076

SCHEMBL21285076

CCC1(CCNCCN2CCN(c3ccc(-c4cc(C(=O)NCc5c(C)cc(C)[nH]c5=O)c5c(C)cn(C(C)C)c5c4)cn3)CC2)CC2CC(C)CC(C2)C1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 18/20 0.68
▸ EZH1 Q92800 4/20 0.68
▸ HDAC6 Q9UBN7 1/20 0.60
▸ EED O75530 3/20 0.60
▸ SUZ12 Q15022 3/20 0.60
▸ HDAC1 Q13547 1/20 0.57
▸ RBBP4 Q09028 1/20 0.52
▸ RBBP7 Q16576 1/20 0.52
▸ AEBP2 Q6ZN18 1/20 0.52

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
SCHEMBL30123148 0.92 EZH2 (0.73) EZH2EZH1HDAC6EEDSUZ12
SCHEMBL21271730 0.92 EZH2 (0.73) EZH2EZH1HDAC6EEDSUZ12
SCHEMBL21285025 0.90 EZH2 (0.65) EZH2EZH1HDAC6EEDSUZ12
SCHEMBL21271725 0.86 EZH2 (0.79) EZH2EZH1HDAC6EEDSUZ12
SCHEMBL30122968 0.86 EZH2 (0.79) EZH2EZH1HDAC6EEDSUZ12
SCHEMBL21285011 0.85 EZH2 (0.71) EZH2EZH1HDAC6EEDSUZ12
SCHEMBL30123014 0.85 EZH2 (0.72) EZH2EZH1HDAC6EEDSUZ12
SCHEMBL21271684 0.85 EZH2 (0.72) EZH2EZH1HDAC6EEDSUZ12
SCHEMBL21271633 0.84 EZH2 (0.73) EZH2EZH1HDAC6EEDSUZ12
SCHEMBL21271632 0.84 EZH2 (0.73) EZH2EZH1HDAC6EEDSUZ12

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-20190255041-A1 COMPOSITIONS AND METHODS FOR TREATING EZH2-MEDIATED CANCER ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI 2019-08-22 — — 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-20190255041-A1 COMPOSITIONS AND METHODS FOR TREATING EZH2-MEDIATED CANCER EZH2, EZH1, EED EZH2 1/4885EZH1 2/4885HDAC6 138/4885

“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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