SCHEMBL571789

SCHEMBL571789

c1ccc(C2CNCC[N]2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
TAAR1 Q96RJ0 2/20 0.39
MAOB P27338 5/20 0.37
MAOA P21397 4/20 0.37
KDM1A O60341 2/20 0.37
NISCH Q9Y2I1 5/20 0.36
DRD1 P21728 2/20 0.35
DRD5 P21918 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
ADCY6 O43306 1/20 0.35
ADCY3 O60266 1/20 0.35
ADCY9 O60503 1/20 0.35
ADCY5 O95622 1/20 0.35
DRD2 P14416 1/20 0.35
ADCY8 P40145 1/20 0.35
ADCY7 P51828 1/20 0.35
ADCY2 Q08462 1/20 0.35
ADCY1 Q08828 1/20 0.35

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
SCHEMBL6073380 0.85 KDM1A (0.46) MAOBMAOAKDM1ANISCHALDH1A1
SCHEMBL878092 0.82 RECQL (0.34) NISCHKDM4EMAPTHSD17B10ALDH1A1
SCHEMBL240623 0.81 ADCY5 (0.38) NISCHMAPTADCY5
SCHEMBL10520604 0.81 TAAR1 (0.39) TAAR1MAOBKDM1AMAPTCYP3A4
SCHEMBL1616732 0.81 KDM1A (0.38) KDM1ATDP1
SCHEMBL9375602 0.81 CYP19A1 (0.33)
SCHEMBL595524 0.81 HTR3A (0.50) TAAR1
SCHEMBL1461219 0.80 CHRNB2 (0.50) KDM1ACYP2C9
SCHEMBL1254610 0.79 SLC6A3 (0.44) TAAR1MAPT
SCHEMBL3666428 0.79 TAAR1 (0.44) TAAR1NISCHNFKB1

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
CN-118184965-A Polyimide-based polymer, and preparation method and application thereof 华南师范大学 2024-06-14 CN claimed
CN-117586233-A Preparation and application of N- [ (1H-indol-4-yl) alkyl ] benzamide compound 沈阳药科大学 2024-02-23 CN claimed
CN-117298148-A Application of aminodithioformate compound or pharmaceutically acceptable salt thereof in combination with copper ions in preparation of antitumor drugs 北京大学 2023-12-29 CN claimed
CN-114751858-B Quinolinyl-containing tranexamic acid derivative and preparation and application thereof 沈阳药科大学 2023-09-12 CN claimed
EP-4100393-A1 NAMPT MODULATORS Cytokinetics, Inc. (US) 2022-12-14 EP claimed
CN-114773267-A [ (7-trifluoromethyl quinoline-4-yl) amino ] benzamide compound and preparation and application thereof 沈阳药科大学 2022-07-22 CN claimed
CN-114751858-A Quinolinyl-containing tranexamic acid derivative, preparation and application thereof 沈阳药科大学 2022-07-15 CN claimed
US-20220128562-A1 BIOMARKERS PREDICTIVE OF CANCER CELL RESPONSE TO ML329 OR A DERIVATIVE THEREOF UNIVERSITY OF KANSAS 2022-04-28 US claimed
CN-110003176-B Amide-containing benzimidazole compound and application thereof 沈阳药科大学 2021-12-21 CN claimed
WO-2021159015-A1 NAMPT MODULATORS CYTOKINETICS, INC. (US) 2021-08-12 WO claimed
EP-0175650-A2 Benzazoles, process for their preparation, pharmaceutical compositions containing them and their use CIBA-GEIGY AG (CH) 1986-03-26 EP claimed
EP-0158278-A2 Oxindole compounds for use against epilepsy HOECHST AKTIENGESELLSCHAFT (DE) 1985-10-16 EP claimed
US-4472400-A Triazoloquinazolones having antihistaminic and bronchospasmolytic activity ROUSSEL UCLAF (FR) 1984-09-18 US claimed
EP-0076199-A2 Triazoloquinazolones and their salts, process and intermediates for preparing them, their use as medicines and compositions containing them ROUSSEL-UCLAF (FR) 1983-04-06 EP claimed
US-4192874-A Substituted 1,2,6,7-tetrahydroindolo[1,7-ab][1,5]benzodiazepines AMERICAN HOECHST CORPORATION (US) 1980-03-11 US claimed
US-4154727-A REACTING A GLYCINAMIDE WITH A HALOACETYL HALIDE SHIONOGI & CO., LTD. (JP) 1979-05-15 US claimed
US-4107437-A SEDATIVES, ANTIARRHYTHMIA AGENTS PARCOR (FR) 1978-08-15 US claimed
US-4081444-A Phenylpiperazinotetrahydronaphthols and derivatives E. R. SQUIBB & SONS, INC. (US) 1978-03-28 US claimed
US-4018773-A Phenylpiperazinotetrahydronaphthols and derivatives E. R. SQUIBB & SONS, INC. (US) 1977-04-19 US claimed
US-3953469-A TRANQUILLIZERS E. R. SQUIBB & SONS, INC. (US) 1976-04-27 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 (1 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-20220128562-A1 BIOMARKERS PREDICTIVE OF CANCER CELL RESPONSE TO ML329 OR A DERIVATIVE THEREOF NQO1, KEAP1, NFE2L2 SLC18A3 4505/4885SIGMAR1 4577/4885TAAR1 4635/4885

“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.