SCHEMBL21628491

SCHEMBL21628491

O=C(O)c1ccc(Oc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)nc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 10/20 0.49
EPAS1 Q99814 4/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
RAB9A P51151 1/20 0.49
MAPT P10636 1/20 0.43
LMNA P02545 2/20 0.42
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CASP2 P42575 1/20 0.41
SERPINE1 P05121 1/20 0.41
MDH1 P40925 1/20 0.41
MDH2 P40926 1/20 0.41
EP300 Q09472 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
IKBKB O14920 1/20 0.40
RARA P10276 1/20 0.40
HRH3 Q9Y5N1 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
SCHEMBL20827018 0.89 MEN1 (0.54) HIF1AEPAS1MEN1KMT2ARAB9A
SCHEMBL20482054 0.87 HIF1A (0.54) HIF1AEPAS1MEN1KMT2ARAB9A
SCHEMBL21628411 0.87 HDAC6 (0.47) HIF1AEPAS1MEN1KMT2ARAB9A
SCHEMBL21628643 0.86 OPRM1 (0.49) HIF1AEPAS1MEN1KMT2ARAB9A
SCHEMBL21628483 0.86 MEN1 (0.45) HIF1AEPAS1MEN1KMT2ARAB9A
SCHEMBL21752956 0.86 MEN1 (0.45) HIF1AEPAS1MEN1KMT2ARAB9A
SCHEMBL21656984 0.84 PDE4B (0.53) HIF1AEPAS1MEN1KMT2ARAB9A
SCHEMBL19362904 0.84 MEN1 (0.55) HIF1AEPAS1MEN1KMT2ARAB9A
SCHEMBL19638786 0.79 ALDH1A1 (0.57) HIF1AMEN1KMT2ARAB9AMAPT
SCHEMBL31225326 0.79 ALDH1A1 (0.57) HIF1AMEN1KMT2ARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12600696-B2 Aromatic compounds Xeniopro GmbH (DE) 2026-04-14 US disclosed
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-12-21 US disclosed
US-20230150923-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-05-18 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2022-11-03 US disclosed
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2021-04-15 US disclosed
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2021-04-15 US disclosed
US-10772876-B2 Enhancers of Notch signaling and the use thereof in the treatment of cancers and malignancies medicable by upregulation of Notch Xeniopro GmbH (DE) 2020-09-15 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 (8 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-10772876-B2 Enhancers of Notch signaling and the use thereof in the treatment of cancers and malignancies medicable by upregulation of Notch NOTCH1, DNER, NOTCH4 HIF1A 2685/4885EPAS1 805/4885MEN1 23/4885
US-20230150923-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HIF1A 2000/4885EPAS1 870/4885MEN1 4341/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HIF1A 2000/4885EPAS1 870/4885MEN1 4341/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK HIF1A 1618/4885EPAS1 982/4885MEN1 4012/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HIF1A 2000/4885EPAS1 870/4885MEN1 4341/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR HIF1A 1180/4885EPAS1 2034/4885MEN1 3190/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HIF1A 2000/4885EPAS1 870/4885MEN1 4341/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HIF1A 2000/4885EPAS1 870/4885MEN1 4341/4885

“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.