SCHEMBL21739856

SCHEMBL21739856

Cc1ccc(F)c2cc(C(=O)Nc3cccc(-c4nnco4)c3)[nH]c12

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SETD2 Q9BYW2 10/20 0.56
▸ NSD2 O96028 3/20 0.51
▸ RAF1 P04049 7/20 0.49
▸ BRAF P15056 7/20 0.49
▸ KAT6A Q92794 1/20 0.43
▸ LCLAT1 Q6UWP7 1/20 0.43

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
SCHEMBL25040262 0.85 SETD2 (0.56) SETD2NSD2LCLAT1
SCHEMBL25039743 0.83 SETD2 (0.56) SETD2NSD2BRAF
SCHEMBL26100274 0.83 SETD2 (0.56) SETD2NSD2LCLAT1
SCHEMBL26098260 0.82 SETD2 (0.55) SETD2NSD2
SCHEMBL25039829 0.81 SETD2 (0.63) SETD2NSD2
SCHEMBL25040178 0.81 SETD2 (0.59) SETD2NSD2
SCHEMBL25040762 0.81 SETD2 (0.59) SETD2NSD2
SCHEMBL26097853 0.81 SETD2 (0.55) SETD2NSD2LCLAT1
SCHEMBL26098336 0.81 SETD2 (0.56) SETD2NSD2KAT6A
SCHEMBL25040666 0.80 SETD2 (0.58) SETD2NSD2

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-12116358-B2 Substituted indoles and methods of use thereof Epizyme, Inc. (US) 2024-10-15 — — US disclosed
US-20230075198-A1 SUBSTITUTED INDOLES AND METHODS OF USE THEREOF Epizyme, Inc. 2023-03-09 — — US disclosed
US-20230049113-A1 METHODS OF TREATING WHSC1-OVEREXPRESSING CANCERS BY INHIBITING SETD2 Epizyme, Inc. 2023-02-16 — — US disclosed
CN-112585119-A Substituted indoles and methods of use thereof EPIZYME股份有限公司 2021-03-30 — — CN disclosed
WO-2020037079-A1 SUBSTITUTED INDOLES AND METHODS OF USE THEREOF Epizyme, Inc. (US) 2020-02-20 — — 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 (3 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-12116358-B2 Substituted indoles and methods of use thereof CCNE1, CCNE2, FOXM1 SETD2 947/4885NSD2 641/4885RAF1 1135/4885
US-20230075198-A1 SUBSTITUTED INDOLES AND METHODS OF USE THEREOF FOXM1, CCNE2, CCNE1 SETD2 1006/4885NSD2 644/4885RAF1 1352/4885
US-20230049113-A1 METHODS OF TREATING WHSC1-OVEREXPRESSING CANCERS BY INHIBITING SETD2 NSD1, NSD3, EHMT1 SETD2 8/4885NSD2 6/4885RAF1 1971/4885

“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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