SCHEMBL25040262

SCHEMBL25040262

Cc1ccc(F)c2cc(C(=O)Nc3cccc(-c4ncco4)c3)[nH]c12

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SETD2 Q9BYW2 11/20 0.56
▸ NSD2 O96028 3/20 0.51
▸ IL2 P60568 1/20 0.48
▸ LCLAT1 Q6UWP7 3/20 0.43
▸ NPC1 O15118 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KIF18A Q8NI77 1/20 0.41
▸ PLA2G7 Q13093 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL25040762 0.85 SETD2 (0.59) SETD2NSD2NPC1MAPTTHRB
SCHEMBL21739856 0.85 SETD2 (0.56) SETD2NSD2LCLAT1
SCHEMBL26100274 0.85 SETD2 (0.56) SETD2NSD2LCLAT1NPC1MAPT
SCHEMBL25040178 0.83 SETD2 (0.59) SETD2NSD2NPC1MAPTTHRB
SCHEMBL25040666 0.82 SETD2 (0.58) SETD2NSD2NPC1MAPTTHRB
SCHEMBL25040301 0.82 SETD2 (0.56) SETD2NSD2NPC1MAPTTHRB
SCHEMBL26098486 0.82 SETD2 (0.55) SETD2NSD2NPC1MAPTTHRB
SCHEMBL25039829 0.81 SETD2 (0.63) SETD2NSD2NPC1MAPTTHRB
SCHEMBL25039719 0.81 SETD2 (0.57) SETD2NSD2
SCHEMBL25039743 0.81 SETD2 (0.56) SETD2NSD2IL2NPC1MAPK1

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 35/4885IL2 2867/4885
US-20230049113-A1 METHODS OF TREATING WHSC1-OVEREXPRESSING CANCERS BY INHIBITING SETD2 NSD1, NSD3, EHMT1 SETD2 8/4885NSD2 6/4885IL2 4334/4885
US-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES EZH2, HDAC2, SETD2 SETD2 3/4885NSD2 14/4885IL2 2169/4885

“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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