SCHEMBL3884707

SCHEMBL3884707

PP(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.53
CYP3A4 P08684 1/20 0.53
ESR1 P03372 4/20 0.39
ESR2 Q92731 4/20 0.39
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 4/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
CA12 O43570 1/20 0.32
GLA P06280 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA14 Q9ULX7 1/20 0.32
LMNA P02545 1/20 0.32
ALOX12 P18054 1/20 0.32
ACHE P22303 1/20 0.32
CA7 P43166 1/20 0.32

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
SCHEMBL4423530 0.71 CYP3A4 (0.45) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL518737 0.69 TDP1 (0.60) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL2085135 0.69 TDP1 (1.00) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL101 0.69 TDP1 (1.00) TDP1CYP3A4ESR1ESR2ALDH1A1
Benzene SCHEMBL6890099 0.69 TDP1 (1.00) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL5028587 0.69 TDP1 (1.00) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL25384985 0.67 TDP1 (0.92) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL22558063 0.67 TDP1 (0.92) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL1195618 0.67 TDP1 (0.92) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL20582981 0.67 TDP1 (0.92) TDP1CYP3A4ESR1ESR2ALDH1A1

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 113 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030120122-A1 Chiral diphenyldiphosphines and d-8 metal complexes thereof PUGIN BENOIT (CH) 2003-06-26 US claimed
EP-1002801-B1 Chiral diphenyldiphosphines and d-8 metal complexes thereof SOLVIAS AG (CH) 2003-06-18 EP claimed
US-6515183-B2 Hydrogenation catalyst SOLVIAS AG (CH) 2003-02-04 US claimed
US-20010056210-A1 Chiral diphenyldiphosphines and d-8 metal complexes thereof PUGIN BENOIT (CH) 2001-12-27 US claimed
EP-1002801-A1 Chiral diphenyldiphosphines and d-8 metal complexes thereof Solvias AG (CH) 2000-05-24 EP claimed
JP-10001491-A None JP disclosed
WO-2023074258-A1 ACTIVE ESTER COMPOUND 東洋紡株式会社 2023-05-04 WO disclosed
WO-2023021900-A1 ACTIVE ESTER COMPOUND 東洋紡株式会社 2023-02-23 WO disclosed
CN-114685408-A Preparation method of alkyl furan compound 华南理工大学 2022-07-01 CN disclosed
CN-110540552-A Aromatic phosphorus oxide compound and preparation method of aromatic phosphorus oxide medicine thereof UNIV HUNAN 2019-12-06 CN disclosed
CN-105392776-B Thio-Salalen catalyst 埃克森美孚化学专利公司 2019-02-12 CN disclosed
CN-105377905-B Metallocenes and catalyst compositions derived therefrom 埃克森美孚化学专利公司 2018-09-14 CN disclosed
US-5801287-A Substituted diphenyldiphosphines and a process for their preparation AVENTIS RESEARCH & TECHNOLOGY GMBH & CO. KG (DE) 1998-09-01 US disclosed
US-5746155-A Water treatment with large numbers of non-pathogenic bacteria to improve yield of aquatic animals LOGAN WALTER T (US) 1998-05-05 US disclosed
JP-H101491-A SUBSTITUTED DIPHENYLDIPHOSPHINE COMPOUND AND ITS PRODUCTION HOECHST AG 1998-01-06 JP disclosed
EP-0795533-A1 Process for the preparation of aldehydes using a catalyst system containing rhodium and substituted diphenyldiphosphanes HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-17 EP disclosed
EP-0795533-A1 Process for the preparation of aldehydes using a catalyst system containing rhodium and substituted diphenyldiphosphanes HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-17 EP disclosed
EP-0795533-A1 Process for the preparation of aldehydes using a catalyst system containing rhodium and substituted diphenyldiphosphanes HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-17 EP disclosed
EP-0795559-A1 Substituted diphenylphosphanes and process for their production HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-17 EP disclosed
EP-0795559-A1 Substituted diphenylphosphanes and process for their production HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-17 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 (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-20030120122-A1 Chiral diphenyldiphosphines and d-8 metal complexes thereof CCNH, DBH, FTH1 TDP1 3670/4885CYP3A4 2788/4885ESR1 2282/4885
US-20010056210-A1 Chiral diphenyldiphosphines and d-8 metal complexes thereof CCNH, OCIAD2, FTH1 TDP1 3505/4885CYP3A4 2994/4885ESR1 2578/4885

“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.