SCHEMBL25039743

SCHEMBL25039743

Cc1ccc(F)c2cc(C(=O)Nc3cccc(-c4cnco4)c3)[nH]c12

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SETD2 Q9BYW2 10/20 0.56
▸ NSD2 O96028 3/20 0.51
▸ BRD4 O60885 2/20 0.47
▸ CREBBP Q92793 2/20 0.47
▸ IMPDH2 P12268 2/20 0.46
▸ BRAF P15056 1/20 0.45
▸ IL2 P60568 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ PKM P14618 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
SCHEMBL25040666 0.84 SETD2 (0.58) SETD2NSD2NPC1RAB9AMAPK1
SCHEMBL25037735 0.84 SETD2 (0.58) SETD2NSD2NPC1RAB9AMAPK1
SCHEMBL25039719 0.83 SETD2 (0.57) SETD2NSD2BRD4CREBBPBRAF
SCHEMBL25040178 0.83 SETD2 (0.59) SETD2NSD2NPC1RAB9AMAPK1
SCHEMBL21739856 0.83 SETD2 (0.56) SETD2NSD2BRAF
SCHEMBL26098336 0.83 SETD2 (0.56) SETD2NSD2NPC1RAB9AMAPK1
SCHEMBL25039829 0.81 SETD2 (0.63) SETD2NSD2NPC1RAB9AMAPK1
SCHEMBL25040762 0.81 SETD2 (0.59) SETD2NSD2NPC1RAB9AMAPK1
SCHEMBL25040262 0.81 SETD2 (0.56) SETD2NSD2IL2NPC1RAB9A
SCHEMBL26099837 0.80 SETD2 (0.56) SETD2NSD2NPC1RAB9AMAPK1

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-20240299352-A1 COMBINATION THERAPIES WITH SETD2 INHIBITORS Epizyme, Inc. 2024-09-12 — — US disclosed
US-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES Epizyme, Inc. (US) 2023-05-04 — — US disclosed
US-20230049113-A1 METHODS OF TREATING WHSC1-OVEREXPRESSING CANCERS BY INHIBITING SETD2 Epizyme, Inc. 2023-02-16 — — 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 (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-20240299352-A1 COMBINATION THERAPIES WITH SETD2 INHIBITORS SETD2, CARM1, SETDB1 SETD2 1/4885NSD2 35/4885BRD4 230/4885
US-20230049113-A1 METHODS OF TREATING WHSC1-OVEREXPRESSING CANCERS BY INHIBITING SETD2 NSD1, NSD3, EHMT1 SETD2 8/4885NSD2 6/4885BRD4 45/4885
US-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES EZH2, HDAC2, SETD2 SETD2 3/4885NSD2 14/4885BRD4 35/4885

“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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