SCHEMBL437438

SCHEMBL437438

O=COCc1ccc(O)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.50
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
CA2 P00918 3/20 0.43
CAMK2A Q9UQM7 1/20 0.43
ABAT P80404 2/20 0.42
ALDH5A1 P51649 1/20 0.42
APP P05067 1/20 0.41
CTBP2 P56545 1/20 0.39

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
SCHEMBL7648199 0.98 IDO1 (0.48) IDO1MEN1KMT2AESR1ESR2
SCHEMBL11392894 0.90 CA2 (0.39) IDO1MEN1KMT2ACA2
Phenol SCHEMBL28213971 0.85 LMNA (0.48) IDO1MEN1KMT2ACA2
SCHEMBL18544386 0.84 LTA4H (0.39) IDO1CA2
SCHEMBL11320245 0.83 IDO1 (0.41) IDO1CA2
SCHEMBL11316154 0.83 ESR1 (0.42) KMT2AESR1ESR2CA2
SCHEMBL6237288 0.80 ESR1 (0.52) KMT2AESR1ESR2CA2
SCHEMBL27652653 0.80 CYP1A2 (0.42) MEN1KMT2AESR1ESR2
SCHEMBL17321077 0.79 TRPA1 (0.39) IDO1CA2
SCHEMBL9881633 0.79 CA2 (0.32) CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5500668-A INK JET PRINTING XEROX CORPORATION (US) 1996-03-19 US claimed
EP-0560269-B1 Substituted pyrrolidine derivatives as HIV protease inhibitors BIO MEGA BOEHRINGER INGELHEIM (CA) 1995-05-31 EP claimed
EP-0560268-B1 Substituted pipecolinic acid derivatives as HIV protease inhibitors BIO MEGA BOEHRINGER INGELHEIM (CA) 1995-01-04 EP claimed
WO-1993018003-A1 SUBSTITUED PIPECOLINIC ACID DERIVATIVES AS HIV PROTEASE INHIBITORS BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1993-09-16 WO claimed
EP-0560269-A1 Substituted pyrrolidine derivatives as HIV protease inhibitors BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1993-09-15 EP claimed
EP-0560268-A1 Substituted pipecolinic acid derivatives as HIV protease inhibitors BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1993-09-15 EP claimed
EP-0062717-B1 A PROCESS FOR THE MANUFACTURE OF AROMATIC CYANIDES A.H. Marks & Co. Limited (GB) 1985-07-03 EP claimed
EP-0062717-A1 A process for the manufacture of aromatic cyanides A.H. Marks & Co. Limited (GB) 1982-10-20 EP claimed
WO-2024133815-A1 ANTIBODY-DRUG CONJUGATES WITH MASKED PBD DIMERS SYNAFFIX B.V. (NL) 2024-06-27 WO disclosed
EP-4389152-A1 CONJUGATES OF PBD PRODRUGS Synaffix B.V. (NL) 2024-06-26 EP disclosed
US-20230346752-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION 2023-11-02 US disclosed
US-20230346752-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION 2023-11-02 US disclosed
US-20230293497-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2023-09-21 US disclosed
US-20230293497-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2023-09-21 US disclosed
EP-0178911-A2 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1986-04-23 EP disclosed
EP-0062717-B1 A PROCESS FOR THE MANUFACTURE OF AROMATIC CYANIDES A.H. Marks & Co. Limited (GB) 1985-07-03 EP disclosed
US-4378319-A Process for the manufacture of aromatic cyanides A. H. MARKS & CO., LIMITED (GB) 1983-03-29 US disclosed
US-4378319-A Process for the manufacture of aromatic cyanides A. H. MARKS & CO., LIMITED (GB) 1983-03-29 US disclosed
EP-0062717-A1 A process for the manufacture of aromatic cyanides A.H. Marks & Co. Limited (GB) 1982-10-20 EP disclosed
EP-0062717-A1 A process for the manufacture of aromatic cyanides A.H. Marks & Co. Limited (GB) 1982-10-20 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 (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-20230293497-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 IDO1 3758/4885MEN1 367/4885KMT2A 2431/4885
US-20230346752-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 IDO1 3758/4885MEN1 367/4885KMT2A 2431/4885

“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.