SCHEMBL14005147

SCHEMBL14005147

Cc1ccc(NC(=O)CI)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.73
TDP1 Q9NUW8 1/20 0.63
HDAC3 O15379 2/20 0.58
HDAC1 Q13547 2/20 0.58
HDAC2 Q92769 2/20 0.58
HDAC10 Q969S8 2/20 0.58
HDAC11 Q96DB2 2/20 0.58
HDAC8 Q9BY41 2/20 0.58
HDAC6 Q9UBN7 2/20 0.58
HDAC4 P56524 1/20 0.58
HDAC7 Q8WUI4 1/20 0.58
HDAC9 Q9UKV0 1/20 0.58
HDAC5 Q9UQL6 1/20 0.58
ALDH1A1 P00352 1/20 0.56
NCOR2 Q9Y618 1/20 0.56
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
HTT P42858 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54

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
Iodoacetamide SCHEMBL21543894 0.93 POLB (0.63) POLBTDP1HDAC3HDAC1HDAC2
SCHEMBL21765862 0.89 MEN1 (0.54) POLBALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL2093668 0.85 POLB (0.76) POLBTDP1HDAC3HDAC1HDAC2
SCHEMBL8141144 0.85 POLB (1.00) POLBTDP1HDAC3HDAC1HDAC2
SCHEMBL16438781 0.84 POLB (0.68) POLBTDP1HDAC3HDAC1HDAC2
SCHEMBL14578751 0.83 POLB (0.85) POLBTDP1HDAC3HDAC1HDAC2
SCHEMBL6003020 0.82 POLB (0.70) POLBTDP1HDAC3HDAC1HDAC2
SCHEMBL10852762 0.81 POLB (0.47) POLBHDAC1HDAC8HDAC6HDAC7
SCHEMBL2093671 0.81 POLB (0.76) POLBTDP1HDAC3HDAC1HDAC2
SCHEMBL10865344 0.81 CYP1A1 (0.60) POLBHDAC4ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11789025-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-17 US claimed
US-10969394-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-04-06 US claimed
US-20210072254-A1 Reagents and Methods for Analysis of Proteins and Metabolites Targeted by Covalent Probes DANA-FARBER CANCER INSTITUTE, INC. 2021-03-11 US claimed
EP-3545314-A1 REAGENTS AND METHODS FOR ANALYSIS OF PROTEINS AND METABOLITES TARGETED BY COVALENT PROBES Dana-Farber Cancer Institute, Inc. (US) 2019-10-02 EP claimed
WO-2018098473-A1 REAGENTS AND METHODS FOR ANALYSIS OF PROTEINS AND METABOLITES TARGETED BY COVALENT PROBES DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-05-31 WO claimed
US-11789025-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-17 US disclosed
US-11789025-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-17 US disclosed
US-11789025-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-17 US disclosed
US-10969394-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-04-06 US disclosed
US-10969394-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-04-06 US disclosed
US-20210072254-A1 Reagents and Methods for Analysis of Proteins and Metabolites Targeted by Covalent Probes DANA-FARBER CANCER INSTITUTE, INC. 2021-03-11 US disclosed
US-20210072254-A1 Reagents and Methods for Analysis of Proteins and Metabolites Targeted by Covalent Probes DANA-FARBER CANCER INSTITUTE, INC. 2021-03-11 US disclosed
US-20140309409-A1 Sialic Acid Derivatives LIPOXEN TECHNOLOGIES LIMITED (GB) 2014-10-16 US disclosed
US-8765936-B2 Sialic acid derivatives LIPOXEN TECHNOLOGIES LIMITED (GB) 2014-07-01 US disclosed
US-20130096294-A1 SIALIC ACID DERIVATIVES LIPOXEN TECHNOLOGIES LIMITED (GB) 2013-04-18 US disclosed
US-20080293660-A1 CHEMICALLY-DEFINED NON-POLYMERIC VALENCY PLATFORM MOLECULES AND CONJUGATES THEREOF LA JOLLA PHARMACEUTICAL COMPANY (US) 2008-11-27 US disclosed
US-7351855-B2 Chemically defined non-polymeric valency platform molecules and conjugates thereof LA JOLLA PHARMACEUTICAL COMPANY (US) 2008-04-01 US disclosed
US-20070254851-A1 Chemically-defined non-polymeric valency platform molecules and conjugates thereof LA JOLLA PHARMACEUTICAL COMPANY 2007-11-01 US disclosed
US-7208156-B2 Composition for inducing humoral anergy to an immunogen comprising a T cell epitope-deficient analog of the immunogen conjugated to a nonimmunogenic valency platform molecule LA JOLLA PHARMACEUTICAL COMPANY (US) 2007-04-24 US disclosed
US-7163683-B2 Composition for inducing humoral anergy to an immunogen comprising a T cell epitope-deficient analog of the immunogen conjugated to a nonimmunogenic valency platform molecule LA JOLLA PHARMACEUTICAL COMPANY (US) 2007-01-16 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 (6 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-20080293660-A1 CHEMICALLY-DEFINED NON-POLYMERIC VALENCY PLATFORM MOLECULES AND CONJUGATES THEREOF SSB, PCNA, NCL POLB 78/4885TDP1 398/4885HDAC3 1080/4885
US-20140309409-A1 Sialic Acid Derivatives NEU2, NEU4, NEU1 POLB 4602/4885TDP1 4159/4885HDAC3 279/4885
US-10969394-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes PTMS, SRMS, HSP90B1 POLB 3536/4885TDP1 3437/4885HDAC3 1109/4885
US-11789025-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes PTMS, SRMS, HSP90B1 POLB 3536/4885TDP1 3437/4885HDAC3 1109/4885
US-20210072254-A1 Reagents and Methods for Analysis of Proteins and Metabolites Targeted by Covalent Probes PTMS, SRMS, HSP90B1 POLB 3536/4885TDP1 3437/4885HDAC3 1109/4885
US-20070254851-A1 Chemically-defined non-polymeric valency platform molecules and conjugates thereof SSB, PCNA, NCL POLB 78/4885TDP1 398/4885HDAC3 1080/4885

“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.