SCHEMBL21808285

SCHEMBL21808285

Clc1cc(Br)ccc1N1CCNCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB1 P08588 6/20 0.56
▸ NCF1 P14598 1/20 0.53
▸ DRD2 P14416 1/20 0.51
▸ DRD3 P35462 1/20 0.51
▸ HTR6 P50406 2/20 0.49
▸ BACE1 P56817 2/20 0.46
▸ HTT P42858 2/20 0.45
▸ HTR3A P46098 5/20 0.45
▸ HTR3E A5X5Y0 4/20 0.45
▸ HTR3B O95264 4/20 0.45
▸ HTR3D Q70Z44 4/20 0.45
▸ HTR3C Q8WXA8 4/20 0.45
▸ SIGMAR1 Q99720 2/20 0.44
▸ CHRM2 P08172 1/20 0.44
▸ CHRM4 P08173 1/20 0.44
▸ CHRM1 P11229 1/20 0.44
▸ CHRM3 P20309 1/20 0.44
▸ CYP1A2 P05177 2/20 0.43
▸ CYP3A4 P08684 2/20 0.43
▸ HTR1A P08908 2/20 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
SCHEMBL8707862 0.83 HTR6 (0.54) ADRB1NCF1HTR6BACE1HTT
SCHEMBL30779215 0.82 ALDH1A1 (0.58) HTTALDH1A1
SCHEMBL18036605 0.82 ALDH1A1 (0.58) HTTALDH1A1
SCHEMBL233944 0.81 HTR3A (0.61) ADRB1DRD2DRD3HTR6HTR3A
SCHEMBL17531624 0.81 ALDH1A1 (0.61) HTTALDH1A1
SCHEMBL29831886 0.81 HTR3A (0.60) ADRB1NCF1DRD2DRD3HTR6
SCHEMBL232523 0.81 HTR3A (0.60) ADRB1NCF1DRD2DRD3HTR6
SCHEMBL7057761 0.80 HTR3A (0.61) ADRB1NCF1HTR6HTTHTR3A
SCHEMBL30221917 0.80 NCF1 (0.51) ADRB1NCF1HTR6BACE1HTT
SCHEMBL7057959 0.80 NCF1 (0.51) ADRB1NCF1HTR6BACE1HTT

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250382277-A1 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF UNIV ARIZONA (US) 2025-12-18 — — US disclosed
US-12441731-B2 Pyrazolopyrimidine compounds and uses thereof INCYTE CORPORATION (US) 2025-10-14 — — US disclosed
EP-4543887-A2 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF Arizona Board of Regents on behalf of The University of Arizona (US) 2025-04-30 — — EP disclosed
EP-3856348-B1 PYRAZOLO[4,3-D]PYRIMIDINE COMPOUNDS AS ALK2 AND/OR FGFR MODULATORS INCYTE CORP (US) 2024-01-03 — — EP disclosed
WO-2023250082-A2 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2023-12-28 — — WO disclosed
US-20220017521-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2022-01-20 — — US disclosed
US-11111247-B2 Pyrazolopyrimidine compounds and uses thereof INCYTE CORPORATION (US) 2021-09-07 — — US disclosed
EP-3856348-A1 PYRAZOLO[4,3-D]PYRIMIDINE COMPOUNDS AS ALK2 ABD/OR FGFR MODULATORS Incyte Corporation (US) 2021-08-04 — — EP disclosed
WO-2020068729-A1 PYRAZOLO[4,3-D]PYRIMIDINE COMPOUNDS AS ALK2 ABD/OR FGFR MODULATORS INCYTE CORPORATION (US) 2020-04-02 — — WO disclosed
US-20200095250-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2020-03-26 — — 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 (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-20200095250-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF ALK, FGFR1, FGFR2 ADRB1 3170/4885NCF1 1832/4885DRD2 4773/4885
US-12441731-B2 Pyrazolopyrimidine compounds and uses thereof ALK, FGFR1, FGFR2 ADRB1 3170/4885NCF1 1832/4885DRD2 4773/4885
US-20250382277-A1 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF CLK2, CLK3, CLK1 ADRB1 3211/4885NCF1 3847/4885DRD2 1555/4885
US-20220017521-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF ALK, FGFR1, FGFR2 ADRB1 3170/4885NCF1 1832/4885DRD2 4773/4885
US-11111247-B2 Pyrazolopyrimidine compounds and uses thereof ALK, FGFR1, FGFR2 ADRB1 3170/4885NCF1 1832/4885DRD2 4773/4885

“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.

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