SCHEMBL21628797

SCHEMBL21628797

CCOC(=O)c1cnc(Oc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 12/20 0.48
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
RAB9A P51151 1/20 0.43
EPAS1 Q99814 3/20 0.41
MDH2 P40926 2/20 0.41
PPARG P37231 2/20 0.41
MDH1 P40925 1/20 0.41
EP300 Q09472 1/20 0.41
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CASP2 P42575 1/20 0.39

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
SCHEMBL21628535 0.89 HIF1A (0.56) HIF1AMEN1KMT2ARAB9AEPAS1
SCHEMBL21628410 0.85 HIF1A (0.48) HIF1AMEN1KMT2ARAB9AEPAS1
SCHEMBL21628466 0.84 HIF1A (0.53) HIF1AMEN1KMT2ARAB9AEPAS1
SCHEMBL21656653 0.84 HIF1A (0.43) HIF1AMEN1KMT2ARAB9AEPAS1
SCHEMBL21656658 0.84 CASP2 (0.42) HIF1AMEN1KMT2ARAB9AEPAS1
SCHEMBL21657041 0.82 HDAC6 (0.43) HIF1AMEN1KMT2ARAB9AEPAS1
SCHEMBL21628452 0.82 HIF1A (0.52) HIF1AMEN1KMT2ARAB9AEPAS1
SCHEMBL21628494 0.82 MAOB (0.37) ALDH1A1LMNAL3MBTL1
SCHEMBL21628493 0.82 MAOB (0.37) ALDH1A1LMNAL3MBTL1
SCHEMBL21628659 0.81 MAOB (0.52) ALDH1A1LMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-12-21 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2021-04-15 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 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 (4 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-11591289-B2 Aromatic compounds AHR, TYR, MUSK HIF1A 1618/4885MEN1 4012/4885KMT2A 248/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HIF1A 2000/4885MEN1 4341/4885KMT2A 313/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HIF1A 2000/4885MEN1 4341/4885KMT2A 313/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HIF1A 2000/4885MEN1 4341/4885KMT2A 313/4885

“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.