SCHEMBL17655658

SCHEMBL17655658

COc1cc(C=O)cc(-c2cc(C=O)cc(OC)c2OC)c1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.53
▸ TSHR P16473 1/20 0.53
▸ HPGD P15428 2/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ TRIM24 O15164 1/20 0.48
▸ ALDH5A1 P51649 1/20 0.48
▸ ABAT P80404 1/20 0.48
▸ TRIM33 Q9UPN9 1/20 0.48
▸ MAPK1 P28482 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ HTR1A P08908 1/20 0.46
▸ HTR2C P28335 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ FDPS P14324 1/20 0.46
▸ CYP1A1 P04798 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP1B1 Q16678 1/20 0.46
▸ MEN1 O00255 2/20 0.45

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
SCHEMBL22824489 0.91 ALDH1A1 (0.46) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL96635 0.89 ALDH1A1 (0.59) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL16619850 0.89 ALDH1A1 (0.59) ALDH1A1TSHRHPGDTDP1TRIM24
Hydrochloric Acid SCHEMBL23711567 0.87 ALDH1A1 (0.57) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL30541333 0.84 TUBB4A (0.51) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL20545861 0.84 TUBB4A (0.51) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL26100046 0.82 ALDH1A1 (0.52) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL5045913 0.82 ALDH1A1 (0.52) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL5044810 0.82 ALDH1A1 (0.52) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL24016983 0.81 TPMT (0.61) ALDH1A1HPGDTDP1TRIM24ALDH5A1

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-11384195-B2 Difunctional biphenyl compounds, preparation, and uses ARIANEGROUP SAS (FR) 2022-07-12 — — US disclosed
EP-3749637-B1 DIFUNCTIONAL BIPHENYL COMPOUNDS, PREPARATION, AND USES ARIANEGROUP SAS (FR) 2021-11-10 — — EP disclosed
US-20200399419-A1 DIFUNCTIONAL BIPHENYL COMPOUNDS, PREPARATION, AND USES ARIANEGROUP SAS (FR) 2020-12-24 — — US disclosed
WO-2019155169-A1 DIFUNCTIONAL BIPHENYL COMPOUNDS, PREPARATION, AND USES ARIANEGROUP SAS (FR) 2019-08-15 — — WO disclosed
US-20190032098-A1 PROCESS FOR PREPARING BIPHENYL COMPOUNDS UNIV BORDEAUX (FR) 2019-01-31 — — US disclosed
US-20170240937-A1 NEW PROCESS FOR PREPARING BIPHENYL COMPOUNDS UNIVERSITÉ DE BORDEAUX (FR) 2017-08-24 — — US disclosed
US-20170240937-A1 NEW PROCESS FOR PREPARING BIPHENYL COMPOUNDS UNIVERSITÉ DE BORDEAUX (FR) 2017-08-24 — — US disclosed
WO-2016050988-A1 NEW PROCESS FOR PREPARING BIPHENYL COMPOUNDS UNIVERSITÉ DE BORDEAUX (FR) 2016-04-07 — — WO disclosed
EP-3002333-A1 Process for preparing biphenyl compounds Université de Bordeaux (FR) 2016-04-06 — — EP 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-20190032098-A1 PROCESS FOR PREPARING BIPHENYL COMPOUNDS CYP1B1, CYP1A1, CYP1A2 ALDH1A1 133/4885TSHR 3579/4885HPGD 743/4885
US-20170240937-A1 NEW PROCESS FOR PREPARING BIPHENYL COMPOUNDS CYP1B1, CYP1A1, CYP1A2 ALDH1A1 85/4885TSHR 4136/4885HPGD 647/4885
US-20200399419-A1 DIFUNCTIONAL BIPHENYL COMPOUNDS, PREPARATION, AND USES ALK, ALKBH3, AHR ALDH1A1 24/4885TSHR 3337/4885HPGD 3155/4885
US-11384195-B2 Difunctional biphenyl compounds, preparation, and uses ALK, ALKBH3, AHR ALDH1A1 24/4885TSHR 3337/4885HPGD 3155/4885

“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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