SCHEMBL4255002

SCHEMBL4255002

[Pd].c1ccc(P(CCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ESR1 P03372 4/20 0.33
ESR2 Q92731 4/20 0.33
KCNA3 P22001 1/20 0.31
CALM1 P0DP23 1/20 0.30
KDM4E B2RXH2 1/20 0.30
GAA P10253 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
SCHEMBL2915801 1.00 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
Hydrochloric Acid SCHEMBL15253811 0.97 CYP3A4 (0.41) CYP3A4TDP1ESR1ESR2
Hydrochloric Acid SCHEMBL1025430 0.97 CYP3A4 (0.41) CYP3A4TDP1ESR1ESR2
SCHEMBL35092 0.97 CYP3A4 (0.45) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL954340 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL7934432 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL556980 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL22749132 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL22749145 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL31379074 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111132981-B Process for preparing pyrido [1,2-A ] pyrimidin-4-one derivatives 豪夫迈·罗氏有限公司 2023-10-31 CN claimed
CN-102617690-B Vitamin d derivatives CHUGAI PHARMACEUTICAL CO LTD 2015-07-08 CN claimed
CN-122029142-A Improved process for synthesizing all (E) -heptaisopentenol (C35-OH) 辛纳吉亚生命科学私人有限公司 2026-05-12 CN disclosed
WO-2026047037-A1 MICROBIOCIDAL QUINOLINE-AMIDE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2026-03-05 WO disclosed
US-20260015309-A1 PROCESS FOR THE SYNTHESIS OF VITAMIN K2 SYNERGIA LIFE SCIENCES PVT. LTD. (IN) 2026-01-15 US disclosed
EP-4663641-A2 PROCESS FOR THE PREPRATION OF 7-(4,7-DIAZASPIRO[2.5]OCTAN-7-YL)-2-(2,8-DIMETHYLIMIDAZO[1,2-B]PYRIDAZIN-6-YL)PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-12-17 EP disclosed
WO-2025233384-A1 MICROBIOCIDAL PYRAZOLE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2025-11-13 WO disclosed
EP-3684766-B1 PROCESS FOR THE PREPRATION OF 7-(4,7-DIAZASPIRO[2.5]OCTAN-7-YL)-2-(2,8-DIMETHYLIMIDAZO[1,2-B]PYRIDAZIN-6-YL)PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2025-10-29 EP disclosed
EP-4615829-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES Syngenta Crop Protection AG (CH) 2025-09-17 EP disclosed
EP-4554925-A1 PROCESS FOR THE SYNTHESIS OF VITAMIN K2 Synergia Life Sciences Pvt. Ltd (IN) 2025-05-21 EP disclosed
WO-2025074315-A2 AN IMPROVED PROCESS FOR THE SYNTHESIS OF ALL (E)-HEPTA PRENOL (C35-OH) SYNERGIA LIFE SCIENCES PVT. LTD. (IN) 2025-04-10 WO disclosed
US-7186865-B2 Reacting optically active secondary amine with alkylation agent in presence of a base, thereby converting the secondary amine into an optically active tertiary amine and subjecting the tertiary amine to hydrogenolysis, producing the N-monoalkyl derivative; intermediates for drugs, agriculture CENTRAL GLASS COMPANY, LIMITED (JP) 2007-03-06 US disclosed
US-6852662-B2 Catalyst systems based on transition metal complexes for carbon monoxide copolymerization in an aqueous medium BASF AKTIENGESELLSCHAFT (DE) 2005-02-08 US disclosed
US-20040235961-A1 Optically active 1-(fluoro-, trifluoromethyl-or trifluoromethoxy-substituted phenyl) alkylamine n-monoalkyl derivatives and process for producing same CENTRAL GLASS COMPANY, LIMITED (JP) 2004-11-25 US disclosed
EP-0732336-B1 Process for the preparation of arylalkyl phosphines, arylalkyl phosphine oxides or arylalkyl phosphine sulfides CYTEC CANADA INC (CA) 2000-12-20 EP disclosed
WO-2000049088-A1 POLYMER BLENDS MADE OF FUNCTIONALISED CARBON MONOXIDE COPOLYMERS AND POLYAMIDES BASF AKTIENGESELLSCHAFT (DE) 2000-08-24 WO disclosed
US-5723621-A Process for processing biaryl compound CHISSO CORPORATION (JP) 1998-03-03 US disclosed
EP-0732336-A1 Process for the preparation of arylalkyl phosphines, arylalkyl phosphine oxides or arylalkyl phosphine sulfides Cytec Canada Inc. (CA) 1996-09-18 EP disclosed
US-5550295-A Preparation of arylalkyl phosphines, phosphine oxides or phosphine sulfides CYTEC TECHNOLOGY CORP. (US) 1996-08-27 US disclosed
US-5510518-A Process for the hydrosulfination of olefins HOECHST AKTIENGESELLSCHAFT (DE) 1996-04-23 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-20260015309-A1 PROCESS FOR THE SYNTHESIS OF VITAMIN K2 PROC, TPRKB, KCNK9 CYP3A4 626/4885TDP1 4788/4885ESR1 1590/4885
US-20040235961-A1 Optically active 1-(fluoro-, trifluoromethyl-or trifluoromethoxy-substituted phenyl) alkylamine n-monoalkyl derivatives and process for producing same NAT1, PNMT, AFF1 CYP3A4 145/4885TDP1 1702/4885ESR1 3786/4885

“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.