SCHEMBL196810

SCHEMBL196810

Br[Ni]Br.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.75
CYP3A4 P08684 1/20 0.75
ESR1 P03372 4/20 0.55
ESR2 Q92731 4/20 0.55
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
ALDH1A1 P00352 4/20 0.35
NPSR1 Q6W5P4 1/20 0.33
DRD1 P21728 2/20 0.32
TSHR P16473 3/20 0.30
BBOX1 O75936 1/20 0.30
EHMT2 Q96KQ7 1/20 0.30
EHMT1 Q9H9B1 1/20 0.30
KCNN4 O15554 1/20 0.30
TRPA1 O75762 1/20 0.30

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
SCHEMBL11677444 1.00 TDP1 (0.75) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL6388599 1.00 TDP1 (0.75) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL11678746 1.00 TDP1 (0.75) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL48782 0.90 TDP1 (0.80) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL28414096 0.88 TDP1 (0.75) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL9510242 0.88 TDP1 (0.75) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL5028587 0.87 TDP1 (1.00) TDP1CYP3A4ESR1ESR2KDM4E
Benzene SCHEMBL6890099 0.87 TDP1 (1.00) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL101 0.87 TDP1 (1.00) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL2085135 0.87 TDP1 (1.00) TDP1CYP3A4ESR1ESR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116947865-B Synthesis method of risperidone intermediate and Li Sipu-blue intermediate 扬州联澳生物医药有限公司 2025-06-13 CN claimed
CN-120025238-A Method for photochemically synthesizing alpha, beta-unsaturated ketone 南京师范大学 2025-05-23 CN claimed
CN-119977940-A Chlorantraniliprole Process for the preparation of amine impurities 合肥工业大学 2025-05-13 CN claimed
CN-119707855-A Optically active amine derivative and asymmetric alkyl synthesis method and application thereof 西南大学 2025-03-28 CN claimed
CN-116375642-B Method for nickel-catalyzed asymmetric aryl alkylation reaction of non-activated olefin 南京师范大学 2025-01-14 CN claimed
CN-118574487-A Application of metal organic compound in perovskite solar cell, perovskite solar cell and preparation method 宣城先进光伏技术有限公司 2024-08-30 CN claimed
CN-118562441-A Single-component sealant and preparation method thereof 广州信粤新材料科技有限公司 2024-08-30 CN claimed
US-12071396-B2 Method for preparing aromatic amino acid derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-08-27 US claimed
CN-118496133-A Method for synthesizing thioamide compound by using aryl chloride and isonitrile 华南理工大学 2024-08-16 CN claimed
EP-3872065-B1 SULFOBIPHENYL COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF SHENYANG SINOCHEM AGROCHEMICALS R & D CO LTD (CN) 2024-07-10 EP claimed
US-20030086859-A1 Method for producing nanocarbon materials CANON KABUSHIKI KAISHA (JP) 2003-05-08 US claimed
US-20030072706-A1 Method for producing fullerenes CANON KABUSHIKI KAISHA 2003-04-17 US claimed
EP-1300363-A2 Method for producing fullerenes CANON KABUSHIKI KAISHA (JP) 2003-04-09 EP claimed
EP-1300364-A2 Method for producing nanocarbon material CANON KABUSHIKI KAISHA (JP) 2003-04-09 EP claimed
EP-0831083-B1 Process for synthesizing benzoic acids ROHM & HAAS (US) 2001-03-14 EP claimed
US-5917079-A Process for synthesizing benzoic acids ROHM AND HAAS COMPANY (US) 1999-06-29 US claimed
EP-0831083-A1 Process for synthesizing benzoic acids ROHM AND HAAS COMPANY (US) 1998-03-25 EP claimed
US-5344900-A Catalytic addition polymerization of norbornenes using nickel, manganese, palladiuma and alumoxanes IDEMITSU KOSAN COMPANY LIMITED (JP) 1994-09-06 US claimed
US-4521589-A CATALYTIC REACTION OF DIHALOGENATED THIOPHENE WITH MAGNESIUM TOKYO INSTITUTE OF TECHNOLOGY (JP) 1985-06-04 US claimed
US-4100338-A Process for preparing solid polymers of norbornadiene SUN OIL COMPANY OF PENNSYLVANIA (US) 1978-07-11 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR TDP1 4450/4885CYP3A4 254/4885ESR1 3084/4885

“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.