SCHEMBL379314

SCHEMBL379314

Cl[Pd](Cl)(P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.45
CYP3A4 P08684 1/20 0.45
TSHR P16473 2/20 0.40
ESR1 P03372 4/20 0.35
ESR2 Q92731 4/20 0.35
ALDH1A1 P00352 3/20 0.32
HSD17B10 Q99714 2/20 0.32
CTSD P07339 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
ALOX15 P16050 1/20 0.30
ALOX12 P18054 1/20 0.30
PTGS1 P23219 1/20 0.30
SLC6A2 P23975 1/20 0.30
MAPK1 P28482 1/20 0.30
PTGS2 P35354 1/20 0.30
HTR2B P41595 1/20 0.30
L3MBTL1 Q9Y468 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
Butane SCHEMBL9850652 0.88 CYP3A4 (0.36) TDP1CYP3A4TSHRESR1ESR2
SCHEMBL1360180 0.75 TDP1 (0.50) TDP1CYP3A4TSHRESR1ESR2
SCHEMBL30827528 0.73 CYP3A4 (0.75) TDP1CYP3A4TSHRESR1ESR2
Ethane SCHEMBL10983356 0.69 TDP1 (0.43) TDP1CYP3A4TSHRESR1ESR2
SCHEMBL246946 0.65
SCHEMBL2939094 0.65 TDP1 (0.53) TDP1CYP3A4TSHRESR1ESR2
SCHEMBL230096 0.65 TDP1 (0.53) TDP1CYP3A4TSHRESR1ESR2
SCHEMBL1951204 0.65 TDP1 (0.86) TDP1CYP3A4TSHRESR1ESR2
SCHEMBL9420677 0.65 TDP1 (0.86) TDP1CYP3A4TSHRESR1ESR2
SCHEMBL11664569 0.65 TDP1 (0.53) TDP1CYP3A4TSHRESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111484503-B Mikanolide derivative and preparation method and application thereof 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) 2022-05-27 CN claimed
CN-111484503-A Mikanolide derivative and preparation method and application thereof 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) 2020-08-04 CN claimed
CN-111039989-A Preparation method of bis (diphenylphosphino) -palladium dichloride chiral catalyst 西安凯立新材料股份有限公司 2020-04-21 CN claimed
WO-2014158647-A1 PREPARATION OF TRIARYL RHAMNOSE CARBAMATES DOW AGROSCIENCES LLC (US) 2014-10-02 WO claimed
US-20140275504-A1 PROCESS FOR THE PREPARATION OF CERTAIN TRIARYL RHAMNOSE CARBAMATES DOW AGROSCIENCES LLC (US) 2014-09-18 US claimed
EP-4570805-A1 TRICYCLIC COMPOUNDS AND MEDICAL USE THEREOF Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2025-06-18 EP disclosed
WO-2025037034-A1 THIENOTHIADIAZINES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2025-02-20 WO disclosed
WO-2024217500-A1 ISOQUINOLINE COMPOUND, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF 上海赛默罗生物科技有限公司 2024-10-24 WO disclosed
EP-4436956-A1 LIGANDS SPECIFICALLY TARGETING VESICULAR GLUTAMATE TRANSPORTERS FOR SUPER-RESOLUTION IMAGING Sorbonne Université (FR) 2024-10-02 EP disclosed
US-20240226104-A1 PI3K INHIBITORS, NANOFORMULATIONS, AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2024-07-11 US disclosed
EP-4326260-A1 PI3K INHIBITORS, NANOFORMULATIONS, AND USES THEREOF The Regents of The University of Michigan (US) 2024-02-28 EP disclosed
CN-117545479-A PI3K inhibitor, nano preparation and application thereof 密歇根大学董事会 2024-02-09 CN disclosed
WO-2001077114-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-10-18 WO disclosed
US-6271234-B1 DERIVATIVES WHICH BIND TO SEROTONERGIC RECEPTORS; TREATING DISORDERS OF THE LOWER URINARY TRACT RECORDATI S.A., CHEMICAL AND PHARMACEUTICAL COMPANY (CH) 2001-08-07 US disclosed
EP-1000046-A1 PIPERAZINE DERIVATIVES ACTIVE ON THE LOWER URINARY TRACT RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 2000-05-17 EP disclosed
EP-1000045-A1 1,4-DISUBSTITUTED PIPERAZINES RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 2000-05-17 EP disclosed
WO-1999006382-A1 1,4-DISUBSTITUTED PIPERAZINES RECORDATI S.A., CHEMICAL AND PHARMACEUTICAL COMPANY (CH) 1999-02-11 WO disclosed
WO-1999006383-A1 PIPERAZINE DERIVATIVES ACTIVE ON THE LOWER URINARY TRACT RECORDATI S.A., CHEMICAL AND PHARMACEUTICAL COMPANY (CH) 1999-02-11 WO disclosed
EP-0489877-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 2-AMINO-6-PHENYL-4H-PYRAN-4-ONES. UPJOHN CO (US) 1992-06-17 EP disclosed
US-4871748-A RODENTICIDES MAY & BAKER LIMITED (GB) 1989-10-03 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 (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-20140275504-A1 PROCESS FOR THE PREPARATION OF CERTAIN TRIARYL RHAMNOSE CARBAMATES BCR, BCHE, C9 TDP1 3639/4885CYP3A4 359/4885TSHR 1033/4885
US-20240226104-A1 PI3K INHIBITORS, NANOFORMULATIONS, AND USES THEREOF PI4KA, PIK3CA, PI4KB TDP1 3513/4885CYP3A4 3228/4885TSHR 3158/4885

“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.