SCHEMBL16627426

SCHEMBL16627426

CCCN1CCCC(F)CC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.43
DRD1 P21728 1/20 0.43
DRD4 P21917 1/20 0.43
DRD5 P21918 1/20 0.43
DRD3 P35462 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
GNAI3 P08754 1/20 0.41
GNAO1 P09471 1/20 0.41
GNAI1 P63096 1/20 0.41

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
SCHEMBL9925579 0.91 DRD2 (0.48) DRD2GNAI3GNAO1GNAI1
SCHEMBL14792301 0.85 DRD2 (0.50) DRD2DRD1DRD4DRD5DRD3
SCHEMBL31345675 0.82 SMN1; SMN2 (0.42) SMN1; SMN2
SCHEMBL17308793 0.79 DRD2 (0.45) DRD2DRD1DRD4DRD5DRD3
SCHEMBL11923 0.79 HRH3 (0.46) GNAI3GNAO1GNAI1
SCHEMBL20080252 0.78 CARM1 (0.50) DRD2DRD1DRD4DRD5DRD3
SCHEMBL16625897 0.78 ARG1 (0.35)
SCHEMBL10129899 0.77
SCHEMBL9925447 0.77
SCHEMBL9925501 0.77

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
WO-2015050472-A1 FUSED INDOLE COMPOUNDS AND METHODS OF USING SAME OBSCHESTVO S OGRANICHENNOY OTVETSTVENNOST'YU "PANACELA LABS" (RU) 2015-04-09 WO disclosed