SCHEMBL2944271

SCHEMBL2944271

N#Cc1ccc(N2CCNCC2)cc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.55
DRD3 P35462 1/20 0.55
ALDH1A1 P00352 1/20 0.52
ADRB1 P08588 4/20 0.47
HTR3E A5X5Y0 2/20 0.46
HTR3B O95264 2/20 0.46
HTR3A P46098 2/20 0.46
HTR3D Q70Z44 2/20 0.46
HTR3C Q8WXA8 2/20 0.46
SIGMAR1 Q99720 2/20 0.46
HTR5A P47898 1/20 0.46
PIM1 P11309 2/20 0.45
CDK9 P50750 2/20 0.45
CDC7 O00311 1/20 0.45
HTR1A P08908 1/20 0.44
HTR7 P34969 1/20 0.44
MAPKAPK2 P49137 1/20 0.44
KDM4E B2RXH2 1/20 0.44
TP53 P04637 1/20 0.44
TRPV4 Q9HBA0 1/20 0.43

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 SCHEMBL29883021 0.98 DRD2 (0.54) DRD2DRD3ALDH1A1ADRB1HTR3E
Hydrochloric Acid SCHEMBL23302481 0.98 DRD2 (0.54) DRD2DRD3ALDH1A1ADRB1HTR3E
SCHEMBL24990144 0.88 PIM1 (0.50) DRD2DRD3ALDH1A1PIM1CDK9
SCHEMBL2927680 0.87 DRD2 (0.55) DRD2DRD3ALDH1A1ADRB1HTR3E
Hydrochloric Acid SCHEMBL20139208 0.86 DRD2 (0.54) DRD2DRD3ALDH1A1ADRB1HTR3E
SCHEMBL30895187 0.85 CYP11B1 (0.51) KDM4ETP53TRPV4PARP1TNK2
SCHEMBL2709917 0.85 DRD2 (0.60) DRD2DRD3ALDH1A1ADRB1HTR3E
SCHEMBL15976200 0.83 CYP11B1 (0.50) ALDH1A1KDM4ETP53TRPV4PARP1
SCHEMBL142269 0.83 CYP11B1 (0.50) ALDH1A1KDM4ETP53TRPV4PARP1
SCHEMBL24990170 0.81 ADRB1 (0.65) DRD2DRD3ADRB1HTR3EHTR3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346573-A1 AZAQUINOLINONE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF CHENGDU EASTON BIOPHARMACEUTICALS CO LTD (CN) 2025-11-13 US disclosed
EP-4534533-A1 AZAQUINOLINONE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF Chengdu Easton Biopharmaceuticals Co., Ltd. (CN) 2025-04-09 EP disclosed
CN-118076597-A Azaquinolinone derivative, preparation method and application thereof 成都苑东生物制药股份有限公司 2024-05-24 CN disclosed
WO-2023232069-A1 AZAQUINOLINONE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF 成都苑东生物制药股份有限公司 2023-12-07 WO disclosed
WO-2023011596-A1 AMIDE COMPOUND AND USE THEREOF 中国药科大学 2023-02-09 WO disclosed
CN-114929673-A Isoquinolinone derivatives, preparation method thereof, and pharmaceutical composition for preventing or treating poly (ADP-ribose) polymerase 1(PARP-1) -related diseases comprising the same as active ingredient 多临生物株式会社 2022-08-19 CN disclosed
WO-2021086077-A1 ISOQUINOLINONE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION, COMPRISING SAME AS ACTIVE INGREDIENT, FOR PREVENTION OR TREATMENT OF POLY(ADP-RIBOSE)POLYMERASE-1 (PARP-1)-ASSOCIATED DISEASE 충남대학교 산학협력단 2021-05-06 WO disclosed
US-20210024495-A1 NOVEL PYRIDAZINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-01-28 US disclosed
WO-2021013830-A1 N-METHYL, N-(6-(METHOXY)PYRIDAZIN-3-YL) AMINE DERIVATIVES AS AUTOTAXIN (ATX) MODULATORS FOR THE TREATMENT OF INFLAMMATORY AIRWAY OR FIBROTIC DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-01-28 WO disclosed
US-7754719-B2 Substituted piperidine derivatives as somatostatin SST1 receptor antagonists NOVARTIS AG (CH) 2010-07-13 US disclosed
US-20050059668-A1 Substituted acylpiperazine derivatives F. HOFFMANN-LA ROCHE AG (CH) 2005-03-17 US disclosed
WO-2005023260-A1 1- (2-AMINO-BENZOL) -PIPERAZINE DERIVATIVES AS GLYCINE UPTAKE INHIBITORS FOR THE TREATMENT OF PSYCHOSES F. HOFFMANN-LA ROCHE AG (CH) 2005-03-17 WO disclosed
WO-2005023261-A1 1-BENZOYL-PIPERAZINE DERIVATIVES AS GLYCINE UPTAKE INHIBITORS FOR THE TREATMENT OF PSYCHOSES F. HOFFMANN-LA ROCHE AG (CH) 2005-03-17 WO disclosed
US-20040220194-A1 2-Alkynyl-and 2-alkenyl-pyrazolo-[4,3-e]-1,2,4-triazolo-[1,5-c]-pyrimidine adenosine A2a receptor antagonists SCHERING CORPORATION 2004-11-04 US disclosed
US-6664258-B1 Transphenylpiperazines; central dopaminergic activity PFIZER INC 2003-12-16 US disclosed
US-6372762-B1 HETEROCYCLIC COMPOUNDS FOR NERVOUS SYSTEM DISORDERS PFIZER INC. 2002-04-16 US disclosed
US-20020019401-A1 Substituted bicyclic derivatives for treating central nervous system disorders FLIRI ANTON FRANZ JOSEPH (US) 2002-02-14 US disclosed
EP-0953567-A2 Bicyclic substituted piperazine-, piperidine- and tetrahydropyridine derivatives, their preparation and their use as agents with central dopaminergic (dopamine D4 receptor) activity Pfizer Products Inc. (US) 1999-11-03 EP disclosed
EP-0925291-A1 SPIROCYCLIC DOPAMINE RECEPTOR SUBTYPE LIGANDS PFIZER INC. (US) 1999-06-30 EP disclosed
WO-1998008835-A1 SPIROCYCLIC DOPAMINE RECEPTOR SUBTYPE LIGANDS PFIZER INC. (US) 1998-03-05 WO 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 (5 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-20020019401-A1 Substituted bicyclic derivatives for treating central nervous system disorders OPRK1, OPRD1, MC2R DRD2 45/4885DRD3 9/4885ALDH1A1 396/4885
US-20050059668-A1 Substituted acylpiperazine derivatives AGPAT5, ACHE, GRIK5 DRD2 126/4885DRD3 457/4885ALDH1A1 395/4885
US-20210024495-A1 NOVEL PYRIDAZINES ENPP2, PLPBP, PRDX6 DRD2 4074/4885DRD3 4090/4885ALDH1A1 4630/4885
US-20040220194-A1 2-Alkynyl-and 2-alkenyl-pyrazolo-[4,3-e]-1,2,4-triazolo-[1,5-c]-pyrimidine adenosine A2a receptor antagonists ADORA2A, ADORA3, ADORA1 DRD2 108/4885DRD3 143/4885ALDH1A1 591/4885
US-20250346573-A1 AZAQUINOLINONE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF PARP1, PARP8, PARP11 DRD2 4067/4885DRD3 4654/4885ALDH1A1 280/4885

“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.