SCHEMBL25039980

SCHEMBL25039980

Cc1ccc(F)c2cc(C(=O)Nc3cccc4ncccc34)[nH]c12

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.57
▸ CYP3A4 P08684 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ POLB P06746 1/20 0.55
▸ MEN1 O00255 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ L3MBTL1 Q9Y468 3/20 0.54
▸ PABPC1 P11940 2/20 0.54
▸ EIF4H Q15056 2/20 0.54
▸ SETD2 Q9BYW2 4/20 0.53
▸ NSD2 O96028 1/20 0.53
▸ HDAC6 Q9UBN7 1/20 0.52
▸ CLK1 P49759 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48

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
SCHEMBL26099783 0.85 NPC1 (0.60) MAPTPOLBMEN1KMT2AL3MBTL1
SCHEMBL25039576 0.83 SETD2 (0.53) CYP1A2CYP3A4MEN1KMT2ASETD2
SCHEMBL25037752 0.80 CNR1 (0.50) ALDH1A1MAPTMEN1KMT2ASETD2
SCHEMBL25040762 0.77 SETD2 (0.59) MAPTSETD2NSD2
SCHEMBL26098096 0.76 SETD2 (0.47) MAPTPOLBMEN1KMT2ASETD2
SCHEMBL17149708 0.75 CYP1A2 (0.61) CYP1A2CYP3A4ALDH1A1MAPTPOLB
SCHEMBL17149778 0.75 CYP1A2 (0.61) CYP1A2CYP3A4ALDH1A1MAPTPOLB
SCHEMBL25040301 0.74 SETD2 (0.56) MAPTSETD2NSD2
SCHEMBL25039719 0.73 SETD2 (0.57) SETD2NSD2
SCHEMBL25040178 0.72 SETD2 (0.59) MAPTSETD2NSD2SMN1; SMN2

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 CYP1A2 4267/4885CYP3A4 4277/4885ALDH1A1 4158/4885
US-20230049113-A1 METHODS OF TREATING WHSC1-OVEREXPRESSING CANCERS BY INHIBITING SETD2 NSD1, NSD3, EHMT1 CYP1A2 4881/4885CYP3A4 4859/4885ALDH1A1 3592/4885
US-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES EZH2, HDAC2, SETD2 CYP1A2 4026/4885CYP3A4 4372/4885ALDH1A1 4808/4885

“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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