SCHEMBL21656485

SCHEMBL21656485

CCOC(=O)c1ccc(Oc2ccc(C(C(F)(F)F)C(F)(F)F)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.49
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ ESR1 P03372 1/20 0.49
▸ CA7 P43166 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ ESR2 Q92731 1/20 0.49
▸ CA14 Q9ULX7 1/20 0.49
▸ STS P08842 1/20 0.48
▸ LMNA P02545 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ MAOA P21397 1/20 0.47
▸ POLB P06746 2/20 0.47
▸ PDK1 Q15118 1/20 0.45
▸ PDK2 Q15119 1/20 0.45
▸ PDK3 Q15120 1/20 0.45
▸ PDK4 Q16654 1/20 0.45
▸ TSHR P16473 3/20 0.44
▸ MAPT P10636 3/20 0.44

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
SCHEMBL21656648 0.85 CA12 (0.41) CA12CA1CA2ESR1CA7
SCHEMBL21656692 0.85 PDE4B (0.53) LMNAPOLBTSHRMAPT
SCHEMBL21656473 0.84 CA1 (0.51) CA12CA1CA2CA7CA9
SCHEMBL8656770 0.83 CA12 (0.68) CA12CA1CA2ESR1CA7
SCHEMBL21656816 0.82 LMNA (0.57) CA12CA1CA2ESR1CA7
SCHEMBL21656669 0.81 CA12 (0.53) CA12CA1CA2ESR1CA7
SCHEMBL21656852 0.81 CA12 (0.53) CA12CA1CA2ESR1CA7
SCHEMBL15964826 0.79 CA1 (0.54) CA12CA1CA2ESR1CA7
SCHEMBL21656675 0.79 SRD5A2 (0.58) CA1CA2POLBTSHRMAPT
SCHEMBL7767342 0.79 KMT2A (0.65) CA12CA1CA2ESR1CA7

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 5 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-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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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-20230150923-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK CA12 4724/4885CA1 4881/4885CA2 4416/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK CA12 4677/4885CA1 4882/4885CA2 4221/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK CA12 4724/4885CA1 4881/4885CA2 4416/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR CA12 1570/4885CA1 3602/4885CA2 1477/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK CA12 4724/4885CA1 4881/4885CA2 4416/4885

“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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