SCHEMBL459763

SCHEMBL459763

COc1c(C)cc(P(Cl)c2cc(C)c(OC)c(C)c2)cc1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
ACHE P22303 1/20 0.36
TDP1 Q9NUW8 1/20 0.31
DHFR P00374 1/20 0.31
TUBB4A P04350 1/20 0.30
TUBB P07437 1/20 0.30
TUBA3C P0DPH7 1/20 0.30
TUBA1B P68363 1/20 0.30
TUBA4A P68366 1/20 0.30
TUBB4B P68371 1/20 0.30
TUBB3 Q13509 1/20 0.30
TUBB2A Q13885 1/20 0.30
TUBB8 Q3ZCM7 1/20 0.30
TUBA3E Q6PEY2 1/20 0.30
TUBA1A Q71U36 1/20 0.30
TUBA1C Q9BQE3 1/20 0.30
TUBB6 Q9BUF5 1/20 0.30
TUBB2B Q9BVA1 1/20 0.30
TUBB1 Q9H4B7 1/20 0.30
CYP3A4 P08684 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
SCHEMBL18798704 0.94 ALDH1A1 (0.37) ALDH1A1ACHETUBB1
SCHEMBL897369 0.80 ACHE (0.39) ALDH1A1ACHETDP1DHFRTUBB1
SCHEMBL1304637 0.78 ALDH1A1 (0.37) ALDH1A1ACHETDP1DHFRCYP3A4
SCHEMBL13453651 0.78 ALDH1A1 (0.37) ALDH1A1ACHETDP1DHFRCYP3A4
SCHEMBL1305179 0.78 ALDH1A1 (0.41) ALDH1A1ACHETDP1DHFR
SCHEMBL2228168 0.76 ACHE (0.52) ALDH1A1ACHETUBB4ATUBBTUBA3C
SCHEMBL11904273 0.76 ALDH1A1 (0.36) ALDH1A1ACHETDP1DHFRCYP3A4
SCHEMBL21061156 0.76 ALDH1A1 (0.36) ALDH1A1ACHETDP1DHFRTUBB4A
Hydrochloric Acid SCHEMBL4534575 0.76 ALDH1A1 (0.36) ALDH1A1ACHETDP1DHFRCYP3A4
SCHEMBL8398815 0.76 ALDH1A1 (0.44) ALDH1A1ACHETDP1DHFRTUBB4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1598053-B1 Use of a composition containing at least one phosphine as majority reducing agent to remove the artificial colour of keratinic fibres OREAL (FR) 2006-12-20 EP claimed
EP-1598053-A1 Use of a composition containing at least one phosphine as majority reducing agent to remove the artificial colour of keratinic fibres L'OREAL (FR) 2005-11-23 EP claimed
US-20050251928-A1 Method for stripping artificial color from keratin fibers L'OREAL (FR) 2005-11-17 US claimed
US-20250368598-A1 CATALYTIC CARBOXYCARBONYLATION OF ALKENES TO FORM ANHYDRIDES BHATTACHARYA SHRABANTI (US) 2025-12-04 US disclosed
CN-119998255-A Catalytic carboxycarbonylation of olefins to form anhydrides 北卡罗来纳大学教堂山分校 2025-05-13 CN disclosed
EP-4543841-A2 CATALYTIC CARBOXYCARBONYLATION OF ALKENES TO FORM ANHYDRIDES The University of North Carolina at Chapel Hill (US) 2025-04-30 EP disclosed
WO-2023250180-A2 CATALYTIC CARBOXYCARBONYLATION OF ALKENES TO FORM ANHYDRIDES THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2023-12-28 WO disclosed
US-20230165771-A1 PROCESS FOR TREATING KERATIN FIBERS USING PARTICULAR AMINO ACIDS IN HIGH CONCENTRATION L'OREAL (FR) 2023-06-01 US disclosed
EP-4171490-A1 PROCESS FOR TREATING KERATIN FIBERS USING PARTICULAR AMINO ACIDS IN HIGH CONCENTRATION L'OREAL (FR) 2023-05-03 EP disclosed
CN-115996701-A Method for treating keratin fibres using a high concentration of a specific amino acid 莱雅公司 2023-04-21 CN disclosed
WO-2022003040-A1 PROCESS FOR TREATING KERATIN FIBERS USING PARTICULAR AMINO ACIDS IN HIGH CONCENTRATION L'OREAL (FR) 2022-01-06 WO disclosed
EP-0987271-A1 An optically active diaminophosphine ligand-transition metal complex Ajinomoto Co., Inc. (JP) 2000-03-22 EP disclosed
EP-0984972-A1 CHIRAL PHOSPHORUS-BASED LIGANDS Chirotech Technology Limited (GB) 2000-03-15 EP disclosed
US-5892044-A ASYMMETRICALLY HYDROGENATING 1-(P-METHOXYBENZYL)-3,4,5,6,7,8-HEXAHYDROISOQUINOLINE OR SALT THEREOF IN PRESENCE OF CATALYTICALLY EFFECTIVE OPTICALLY ACTIVE IRIDIUM-PHOSPHINE COMPLEX LONZA LTD. (CH) 1999-04-06 US disclosed
WO-1998054193-A1 CHIRAL PHOSPHORUS-BASED LIGANDS CHIROTECH TECHNOLOGY LIMITED (GB) 1998-12-03 WO disclosed
EP-0739333-B1 SELECTIVE ASYMMETRIC HYDROGENATION OF DEHYDROAMINO ACID DERIVATIVES USING RHODIUM AND IRIDIUM DIPHOSPHINITE CARBOHYDRATE CATALYST COMPOSITIONS DU PONT (US) 1998-10-14 EP disclosed
EP-0839135-A1 PROCESS FOR PREPARING OPTICALLY ACTIVE 1-(P-METHOXYBENZYL)-1,2,3,4,5,6,7,8-OCTAHYDROISOQUINOLINE LONZA AG (CH) 1998-05-06 EP disclosed
WO-1997003052-A1 PROCESS FOR PREPARING OPTICALLY ACTIVE 1-(P-METHOXYBENZYL)-1,2,3,4,5,6,7,8-OCTAHYDROISOQUINOLINE LONZA AG (CH) 1997-01-30 WO disclosed
US-5510507-A COORDINATION CATALYSTS; EFFICIENT ENANTIOSELECTIVITY E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-04-23 US disclosed
US-5481006-A PREPARATION OF INTERMEDIATES FOR PHARMACEUTICALS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-01-02 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 (3 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-20250368598-A1 CATALYTIC CARBOXYCARBONYLATION OF ALKENES TO FORM ANHYDRIDES CA4, CA12, CA14 ALDH1A1 688/4885ACHE 2398/4885TDP1 3585/4885
US-20230165771-A1 PROCESS FOR TREATING KERATIN FIBERS USING PARTICULAR AMINO ACIDS IN HIGH CONCENTRATION KRT18, CKAP4, VIM ALDH1A1 4235/4885ACHE 3912/4885TDP1 3775/4885
US-20050251928-A1 Method for stripping artificial color from keratin fibers KRT18, DSG1, JUP ALDH1A1 4512/4885ACHE 704/4885TDP1 3996/4885

“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.