SCHEMBL189872

SCHEMBL189872

CN1CCN(C(N)=O)CC1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
HTR1A P08908 1/20 0.46
PHGDH O43175 1/20 0.42
MGLL Q99685 1/20 0.42
HTT P42858 2/20 0.42
HSD11B1 P28845 1/20 0.42
POLB P06746 2/20 0.41
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 2/20 0.39
EPHX2 P34913 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
Hydrochloric Acid SCHEMBL3228161 0.97 CYP1A2 (0.56) CYP1A2TDP1HTR1APHGDHMGLL
Hydrochloric Acid SCHEMBL7438943 0.97 CYP1A2 (0.56) CYP1A2TDP1HTR1APHGDHMGLL
SCHEMBL14534799 0.91 HTT (0.55) CYP1A2TDP1HTR1AHTTPOLB
Methylpiperazine SCHEMBL11736744 0.87 CYP1A2 (0.46) CYP1A2TDP1HTR1APHGDHMGLL
SCHEMBL422638 0.85
SCHEMBL572569 0.85 ALDH1A1 (0.45) CYP1A2TDP1HTR1AHTTPOLB
Carbamic Acid SCHEMBL29922252 0.79 CYP1A2 (0.52) CYP1A2TDP1HTR1AHTTHSD11B1
Acetamide SCHEMBL4743096 0.79 CYP1A2 (0.60) CYP1A2TDP1HTR1APHGDHMGLL
SCHEMBL2133787 0.79 CYP1A2 (0.54) CYP1A2TDP1HTR1APHGDHMGLL
SCHEMBL31706681 0.79 CYP1A2 (0.46) CYP1A2TDP1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4619106-A2 TREATMENT OF ASCT2-DEPENDENT CANCERS Neupharma, Inc (US) 2025-09-24 EP claimed
WO-2024107753-A2 TREATMENT OF ASCT2-DEPENDENT CANCERS NEUPHARMA, INC (US) 2024-05-23 WO claimed
CN-116283920-B 2, 4-disubstituted pyridine compound and application thereof 贵州医科大学 2024-04-16 CN claimed
CN-117510413-A DCLK1 kinase inhibitor and preparation method and application thereof 杭州医学院 2024-02-06 CN claimed
US-20230265083-A1 Heterocycle CDK Inhibitors And Their Use Thereof PRELUDE THERAPEUTICS INCORPORATED 2023-08-24 US claimed
US-20230242543-A1 CDK Inhibitors And Their Use As Pharmaceuticals PRELUDE THERAPEUTICS INCORPORATED 2023-08-03 US claimed
CN-116283920-A 2, 4-disubstituted pyridine compound and application thereof 贵州医科大学 2023-06-23 CN claimed
CN-116239580-A Triazine compound and preparation method, pharmaceutical composition and application thereof 中国药科大学 2023-06-09 CN claimed
US-20230144528-A1 CDK Inhibitors And Their Use As Pharmaceuticals PRELUDE THERAPEUTICS, INCORPORATED 2023-05-11 US claimed
WO-2023056441-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS INCORPORATED (US) 2023-04-06 WO claimed
WO-2001010835-A1 ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2001-02-15 WO claimed
EP-1024407-A1 POSITIVE PHOTOSENSITIVE POLYIMIDE COMPOSITION PI R & D Co Ltd (JP) 2000-08-02 EP claimed
WO-1999058549-A1 MEIOSIS REGULATING COMPOUNDS NOVO NORDISK A/S (DK) 1999-11-18 WO claimed
EP-0710293-A1 LYOPHILIZED LIGAND-RECEPTOR COMPLEXES FOR ASSAYS AND SENSORS U.S. DRUG TESTING, INC. (US) 1996-05-08 EP claimed
WO-1995002703-A1 LYOPHILIZED LIGAND-RECEPTOR COMPLEXES FOR ASSAYS AND SENSORS U.S. DRUG TESTING, INC. (US) 1995-01-26 WO claimed
WO-1994024095-A1 IMMUNOSUPPRESSIVE AGENTS ABBOTT LABORATORIES (US) 1994-10-27 WO claimed
US-5354654-A Lyophilized ligand-receptor complexes for assays and sensors THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1994-10-11 US claimed
US-5096978-A Butadiene polymers having improved scorch delay and fast cure rates; tires; treads MONSANTO COMPANY (US) 1992-03-17 US claimed
EP-0364428-A1 Vulcanizable synthetic rubber compositions cure-activated by substituted ureas Monsanto Company (US) 1990-04-18 EP claimed
US-3981868-A MICROBIOCIDES, HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1976-09-21 US claimed

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-20230144528-A1 CDK Inhibitors And Their Use As Pharmaceuticals CDK6, CDK3, CDK9 CYP1A2 2671/4885TDP1 321/4885HTR1A 3126/4885
US-20230265083-A1 Heterocycle CDK Inhibitors And Their Use Thereof CDK3, CDK8, CDK9 CYP1A2 1943/4885TDP1 367/4885HTR1A 3236/4885
US-20230242543-A1 CDK Inhibitors And Their Use As Pharmaceuticals CDK6, CDK3, CDK9 CYP1A2 2671/4885TDP1 321/4885HTR1A 3126/4885

“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.