SCHEMBL3793301

SCHEMBL3793301

NCCc1cnn2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 13/20 0.51
DRD4 P21917 7/20 0.51
EPHB3 P54753 2/20 0.50
DRD2 P14416 7/20 0.45
HTR1A P08908 1/20 0.45
DRD1 P21728 1/20 0.45
ADRA1D P25100 1/20 0.45
ADRA1A P35348 1/20 0.45
ADRA1B P35368 1/20 0.45
HDAC1 Q13547 2/20 0.43
HTR2A P28223 1/20 0.41
KCNH2 Q12809 1/20 0.39
TAAR1 Q96RJ0 2/20 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 SCHEMBL3795002 0.98 DRD3 (0.50) DRD3DRD4EPHB3DRD2HTR1A
SCHEMBL29535086 0.85 DRD3 (0.54) DRD3DRD4EPHB3DRD2HTR1A
SCHEMBL23587071 0.82 DRD3 (0.55) DRD3DRD4EPHB3DRD2HTR1A
SCHEMBL6610807 0.81 DRD3 (0.57) DRD3DRD4EPHB3DRD2HTR1A
SCHEMBL20653885 0.78 DRD3 (0.51) DRD3DRD4EPHB3DRD2HTR1A
SCHEMBL25297439 0.78 DRD3 (0.51) DRD3DRD4EPHB3DRD2HTR1A
SCHEMBL16050082 0.78 DRD3 (0.54) DRD3DRD4EPHB3DRD2HTR1A
SCHEMBL9610941 0.78 DRD3 (0.58) DRD3DRD4EPHB3DRD2HTR1A
SCHEMBL22792160 0.78 DRD3 (0.54) DRD3DRD4EPHB3DRD2HTR1A
SCHEMBL6612386 0.78 DRD3 (0.54) DRD3DRD4EPHB3DRD2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010136037-A1 NOVEL CALCIUM SENSING RECEPTOR MODULATING COMPOUNDS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2010-12-02 WO claimed
US-20250059184-A1 IMIDAZOPYRIDINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2025-02-20 US disclosed
WO-2024123966-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT KINASE INHIBITORS THIRD HARMONIC BIO, INC. (US) 2024-06-13 WO disclosed
WO-2023114844-A1 IMIDAZOPYRIDINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. (US) 2023-06-22 WO disclosed
WO-2023114844-A1 IMIDAZOPYRIDINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. (US) 2023-06-22 WO disclosed
WO-2010136037-A1 NOVEL CALCIUM SENSING RECEPTOR MODULATING COMPOUNDS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2010-12-02 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 (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-20250059184-A1 IMIDAZOPYRIDINE PSYCHOPLASTOGENS AND USES THEREOF GRIN2A, GAP43, GRIN2C DRD3 225/4885DRD4 187/4885EPHB3 840/4885

“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.