SCHEMBL17734413

SCHEMBL17734413

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(-c2ccc(N3CCN(C)CC3)nc2)cc2c1ccn2C1CCOCC1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 14/20 0.71
▸ EZH1 Q92800 7/20 0.70
▸ EED O75530 2/20 0.70
▸ RBBP4 Q09028 2/20 0.70
▸ SUZ12 Q15022 2/20 0.70
▸ AEBP2 Q6ZN18 2/20 0.70
▸ PRMT3 O60678 1/20 0.70
▸ RBBP7 Q16576 1/20 0.70
▸ SETD7 Q8WTS6 1/20 0.70

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
SCHEMBL2595575 0.95 EZH2 (0.74) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL23863678 0.94 EZH1 (0.64) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL20621469 0.94 EZH2 (0.71) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL17734418 0.88 EZH2 (0.56) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL17734356 0.87 EZH2 (0.57) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL17734421 0.87 EZH2 (0.55) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL2592678 0.87 EZH2 (0.81) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL17734412 0.86 EZH2 (0.55) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL12180870 0.86 EZH1 (0.86) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL20621515 0.85 EZH2 (0.56) EZH2EZH1EEDRBBP4SUZ12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236082-B2 EZH2 inhibitors and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-02-01 — — US disclosed
EP-3885343-A1 INDOLE COMPOUNDS AS EZH2 INHIBITORS AND USES THEREOF Dana-Farber Cancer Institute, Inc. (US) 2021-09-29 — — EP disclosed
US-20190000860-A1 USE OF COMPOSITIONS MODULATING CHROMATIN STRUCTURE FOR GRAFT VERSUS HOST DISEASE (GVHD) DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-01-03 — — US disclosed
WO-2016073956-A1 EZH2 INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-05-12 — — WO disclosed
WO-2016073903-A1 USE OF COMPOSITIONS MODULATING CHROMATIN STRUCTURE FOR GRAFT VERSUS HOST DISEASE (GVHD) DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-05-12 — — 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 (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-20190000860-A1 USE OF COMPOSITIONS MODULATING CHROMATIN STRUCTURE FOR GRAFT VERSUS HOST DISEASE (GVHD) BCL6, BCL6B, EZH2 EZH2 3/4885EZH1 31/4885EED 58/4885
US-11236082-B2 EZH2 inhibitors and uses thereof EZH2, EZH1, BMI1 EZH2 1/4885EZH1 2/4885EED 5/4885

“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.

Send feedback