SCHEMBL2923685

SCHEMBL2923685

Nc1ccc([N+](=O)[O-])cc1C=O

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.65
TDP1 Q9NUW8 6/20 0.57
ALDH1A1 P00352 8/20 0.55
CYP3A4 P08684 4/20 0.55
TSHR P16473 3/20 0.53
GAA P10253 2/20 0.53
THRB P10828 1/20 0.53
HTT P42858 1/20 0.50
ALOX15 P16050 1/20 0.49
PTPN1 P18031 1/20 0.47
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.44

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
SCHEMBL30586446 1.00 ERN1 (0.65) ERN1TDP1ALDH1A1CYP3A4TSHR
SCHEMBL2652355 0.88 ERN1 (0.69) ERN1TDP1ALDH1A1CYP3A4TSHR
SCHEMBL2616938 0.86 ERN1 (0.58) ERN1TDP1ALDH1A1CYP3A4TSHR
SCHEMBL29051806 0.82 TDP1 (0.55) ERN1TDP1ALDH1A1CYP3A4TSHR
SCHEMBL14595562 0.82 TDP1 (0.55) ERN1TDP1ALDH1A1CYP3A4TSHR
SCHEMBL10889677 0.82 ALDH1A1 (0.58) ERN1TDP1ALDH1A1CYP3A4TSHR
SCHEMBL31098731 0.82 ERN1 (0.67) ERN1TDP1ALDH1A1CYP3A4TSHR
SCHEMBL12798324 0.82 ERN1 (0.67) ERN1TDP1ALDH1A1CYP3A4TSHR
SCHEMBL14429947 0.80 ERN1 (0.56) ERN1TDP1ALDH1A1CYP3A4TSHR
SCHEMBL1800032 0.80 ERN1 (0.65) ERN1TDP1ALDH1A1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240307547-A1 NOVEL COMPOUNDS WHICH BIND TO CEREBLON, AND METHODS OF USE THEREOF CAPTOR THERAPEUTICS S.A. (PL) 2024-09-19 US disclosed
US-20240294499-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN CAPTOR THERAPEUTICS S.A. (PL) 2024-09-05 US disclosed
CN-117957218-A Targeted protein degradation using bifunctional compounds that bind to ubiquitin ligases and target MCL-1 proteins 凯普托尔治疗学股份有限公司 2024-04-30 CN disclosed
EP-4347579-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN Captor Therapeutics S.A. (PL) 2024-04-10 EP disclosed
EP-4271670-A1 NOVEL COMPOUNDS WHICH BIND TO CEREBLON, AND METHODS OF USE THEREOF Captor Therapeutics S.A. (PL) 2023-11-08 EP disclosed
CN-116917275-A Novel CEREBLON-binding compounds and methods of use thereof 凯普托尔治疗学股份有限公司 2023-10-20 CN disclosed
WO-2022253713-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN CAPTOR THERAPEUTICS S.A. (PL) 2022-12-08 WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
WO-2022144416-A1 NOVEL COMPOUNDS WHICH BIND TO CEREBLON, AND METHODS OF USE THEREOF CAPTOR THERAPEUTICS S.A. (PL) 2022-07-07 WO disclosed
WO-2021014415-A2 SMALL MOLECULE INHIBITORS OF ACETYL COENZYME A SYNTHETASE SHORT CHAIN 2 (ACSS2) CURADEV PHARMA PVT. LTD. (IN) 2021-01-28 WO disclosed
EP-0436653-A1 SYNTHESIS OF CAMPTOTHECIN AND ANALOGS THEREOF RESEARCH TRIANGLE INSTITUTE (US) 1991-07-17 EP disclosed
WO-1991005556-A1 CAMPTOTHECIN ANALOGS AS POTENT INHIBITORS OF HUMAN COLORECTAL CANCER RESEARCH TRIANGLE INSTITUTE (US) 1991-05-02 WO disclosed
US-4981968-A ENZYME INHIBITORS, ANTITUMOR RESEARCH TRIANGLE INSTITUTE (US) 1991-01-01 US disclosed
WO-1990003169-A1 SYNTHESIS OF CAMPTOTHECIN AND ANALOGS THEREOF RESEARCH TRIANGLE INSTITUTE (US) 1990-04-05 WO disclosed
US-4894456-A CYCLIZATION, ESTERIFICATION RESEARCH TRIANGLE INSTITUTE (US) 1990-01-16 US disclosed
US-4404201-A N-/ /ALKANOYLAMINOALKANOYLAMINO OR AMINOALKANOYL AMINO/-DIHYDRO-OXO-3-QUINOLINYLCARBONYL/- DERIVATIVES WARNER-LAMBERT COMPANY (US) 1983-09-13 US disclosed
US-4382089-A Antibacterial amide compounds, compositions thereof and methods of using them WARNER-LAMBERT COMPANY (US) 1983-05-03 US disclosed
US-4374138-A PENICILLINS WARNER-LAMBERT COMPANY (US) 1983-02-15 US disclosed
US-4268510-A DEMETHANIZATION, METABOLISM, RUMEN IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-05-19 US disclosed
EP-0010348-A1 Heterocyclic trichloromethyl derivatives, process for their preparation and their use IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-04-30 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-20240294499-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN MCL1, MDM2, XIAP ERN1 1126/4885TDP1 3302/4885ALDH1A1 956/4885
US-20240307547-A1 NOVEL COMPOUNDS WHICH BIND TO CEREBLON, AND METHODS OF USE THEREOF CRBN, CDR2, FABP7 ERN1 4237/4885TDP1 4453/4885ALDH1A1 3123/4885

“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.