SCHEMBL25601593

SCHEMBL25601593

CCCN1CCCC(COC)C1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.46
DRD1 P21728 1/20 0.46
DRD4 P21917 1/20 0.46
DRD5 P21918 1/20 0.46
DRD3 P35462 1/20 0.46
KDM2B Q8NHM5 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
SCHEMBL12335282 0.89 DRD2 (0.40) DRD2DRD1DRD4DRD5DRD3
SCHEMBL7702796 0.85 NPSR1 (0.40) DRD2DRD3KDM2B
SCHEMBL770731 0.84 NPSR1 (0.38) DRD2KDM2B
SCHEMBL14012777 0.84 ACHE (0.40)
SCHEMBL23588529 0.83 DRD2 (0.42) DRD2DRD1DRD4DRD5DRD3
SCHEMBL19709189 0.83 DRD2 (0.42) DRD2DRD1DRD4DRD5DRD3
SCHEMBL12718221 0.82 DRD4 (0.50) DRD2DRD1DRD4DRD5DRD3
SCHEMBL10077156 0.82 DRD4 (0.50) DRD2DRD1DRD4DRD5DRD3
SCHEMBL12718206 0.82 DRD4 (0.50) DRD2DRD1DRD4DRD5DRD3
Hydrochloric Acid SCHEMBL31371708 0.82 NPSR1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3442947-B1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS AS EHMT1 AND EHMT2 INHIBITORS EPIZYME INC (US) 2023-06-07 EP disclosed