SCHEMBL29848758

SCHEMBL29848758

O=c1[nH]cccc1OCC(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.43
▸ GAA P10253 5/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ BLM P54132 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ THRB P10828 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ USP2 O75604 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.39
▸ G6PD P11413 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ DAO P14920 1/20 0.38
▸ AURKA O14965 1/20 0.38
▸ AURKB Q96GD4 1/20 0.38

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
SCHEMBL27261099 0.76 KDM4E (0.44) KDM4EGAAKMT2AL3MBTL1BLM
SCHEMBL16710170 0.74 PIM1 (0.43) KDM4EGAAKMT2AL3MBTL1MEN1
SCHEMBL28288419 0.74 MAPT (0.52) KDM4EGAAKMT2AL3MBTL1MEN1
SCHEMBL28081005 0.73 MAPT (0.35) KDM4EGAAKMT2AL3MBTL1MEN1
SCHEMBL2314773 0.72 KDM4E (0.49) KDM4EGAAKMT2AL3MBTL1MEN1
SCHEMBL945488 0.71 L3MBTL1 (0.50) KDM4EGAAKMT2AL3MBTL1BLM
SCHEMBL8133180 0.71 KDM4E (0.59) KDM4EKMT2AL3MBTL1MEN1MAPT
SCHEMBL2881510 0.71 SCN8A (0.43) KDM4EGAAL3MBTL1PARP1
SCHEMBL3032749 0.71 MAPT (0.45) KDM4EGAAKMT2AL3MBTL1MEN1
SCHEMBL10755910 0.70 KMT2A (0.49) KDM4EGAAKMT2AL3MBTL1BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240182490-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2024-06-06 — — US disclosed
US-20220315601-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2022-10-06 — — 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 (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-20240182490-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 KDM4E 137/4885GAA 2844/4885KMT2A 77/4885
US-20220315601-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 KDM4E 137/4885GAA 2844/4885KMT2A 77/4885

“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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