SCHEMBL658661

SCHEMBL658661

O=C(CC(c1ccccc1)C(C(=O)O)C(=O)O)c1ccc(C(F)(F)F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 4/20 1.00
HSD11B1 P28845 1/20 0.50
PTPN1 P18031 2/20 0.49
GSK3B P49841 2/20 0.49
LDHA P00338 1/20 0.46
LDHB P07195 1/20 0.46
ACP3 P15309 1/20 0.44
EEF2K O00418 1/20 0.44
TSHR P16473 1/20 0.44
CES2 O00748 2/20 0.43
CES1 P23141 2/20 0.43
MMP1 P03956 1/20 0.43
SRD5A2 P31213 1/20 0.42
CACNA1A O00555 1/20 0.42
CACNA2D1 P54289 1/20 0.42
CACNA1B Q00975 1/20 0.42
CACNB1 Q02641 1/20 0.42
CACNA1C Q13936 1/20 0.42
CYP1A1 P04798 1/20 0.42
MAOB P27338 1/20 0.42

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
SCHEMBL25737214 0.88 PDPK1 (0.79) PDPK1HSD11B1PTPN1GSK3BLDHA
SCHEMBL657567 0.87 PDPK1 (0.78) PDPK1PTPN1GSK3BCES2CES1
SCHEMBL2141566 0.84 PDPK1 (0.78) PDPK1PTPN1GSK3BTSHRCES1
SCHEMBL2142669 0.83 PDPK1 (0.72) PDPK1HSD11B1PTPN1TSHRNPC1
SCHEMBL657351 0.81 PDPK1 (0.67) PDPK1HSD11B1PTPN1GSK3BLDHA
SCHEMBL10252711 0.80 PDPK1 (0.72) PDPK1HSD11B1GSK3BTSHRCES2
SCHEMBL658265 0.80 PDPK1 (0.72) PDPK1TSHRMMP1
SCHEMBL656820 0.80 PDPK1 (1.00) PDPK1GSK3BTSHR
SCHEMBL657341 0.80 PDPK1 (0.72) PDPK1HSD11B1GSK3BTSHRNPC1
SCHEMBL658415 0.79 PDPK1 (0.66) PDPK1HSD11B1PTPN1GSK3BLDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4605376-A1 ISOQUINOLINE DERIVATIVES AS PROTEIN DEGRADERS, E7 DEGRADERS, ANTIVIRALS, TUMOR THERAPEUTICS AND IMMUNE SUPPRESSIVES RDP Pharma AG (CH) 2025-08-27 EP claimed
CN-120202190-A Isoquinoline derivatives as protein degrading agents, E7 degrading agents, antiviral agents, tumor therapeutic agents and immunosuppressants RDP制药股份公司 2025-06-24 CN claimed
EP-4548977-A2 NOVEL ISOQUINOLINES AS PROTEIN DEGRADERS, E7 DEGRADERS, ANTIVIRALS, TUMOR THERAPEUTICS AND IMMUNE SUPPRESSIVES RDP Pharma AG (CH) 2025-05-07 EP claimed
WO-2024083802-A1 ISOQUINOLINE DERIVATIVES AS PROTEIN DEGRADERS, E7 DEGRADERS, ANTIVIRALS, TUMOR THERAPEUTICS AND IMMUNE SUPPRESSIVES VALDOSPAN GMBH (AT) 2024-04-25 WO claimed
EP-4322949-A1 ISOQUINOLINE DERIVATIVES FOR USE AS ANTIVIRAL AND ANTITUMOUR AGENTS RDP Pharma AG (CH) 2024-02-21 EP claimed
CN-117377474-A Isoquinoline derivatives as antiviral and antitumor agents RDP制药股份公司 2024-01-09 CN claimed
WO-2022219157-A1 ISOQUINOLINE DERIVATIVES FOR USE AS ANTIVIRAL AND ANTITUMOUR AGENTS VALDOSPAN GMBH (AT) 2022-10-20 WO claimed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO claimed
WO-2026090483-A1 METABOLITE FOR TREATING NEUROLOGICAL DISEASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2026-04-30 WO disclosed
US-20250277062-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF THE BROAD INSTITUTE, INC. 2025-09-04 US disclosed
US-12404348-B2 Bifunctional chimeric molecules for labeling of kinases with target binding moieties and methods of use thereof THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2025-09-02 US disclosed
EP-4605376-A1 ISOQUINOLINE DERIVATIVES AS PROTEIN DEGRADERS, E7 DEGRADERS, ANTIVIRALS, TUMOR THERAPEUTICS AND IMMUNE SUPPRESSIVES RDP Pharma AG (CH) 2025-08-27 EP disclosed
US-20250255875-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2025-08-14 US disclosed
EP-4598633-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF The Brigham & Women's Hospital, Inc. (US) 2025-08-13 EP disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP disclosed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO disclosed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO disclosed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 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 (4 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-20250277062-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF ERBB2, ACP1, TK1 PDPK1 158/4885HSD11B1 4168/4885PTPN1 1255/4885
US-20250255875-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF ERBB2, ACP1, TK1 PDPK1 158/4885HSD11B1 4168/4885PTPN1 1255/4885
US-12404348-B2 Bifunctional chimeric molecules for labeling of kinases with target binding moieties and methods of use thereof ERBB2, ACP1, TK1 PDPK1 158/4885HSD11B1 4168/4885PTPN1 1255/4885
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB PDPK1 109/4885HSD11B1 4102/4885PTPN1 1145/4885

“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.