SCHEMBL23323101

SCHEMBL23323101

CCCc1ccccc1C1CCCN1NC

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 2/20 0.35
▸ DRD2 P14416 2/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ CHRNB2 P17787 1/20 0.34
▸ CHRNB4 P30926 1/20 0.34
▸ CHRNA3 P32297 1/20 0.34
▸ CHRNA4 P43681 1/20 0.34
▸ HRH3 Q9Y5N1 2/20 0.33
▸ DRD1 P21728 1/20 0.33
▸ DRD4 P21917 1/20 0.33
▸ DRD5 P21918 1/20 0.33
▸ DRD3 P35462 1/20 0.33

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
SCHEMBL24775485 0.81 CHRNB2 (0.51) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL24775061 0.77 CHRNA7 (0.35) CHRNA7DRD2HTR1ACHRNB2CHRNB4
SCHEMBL28533797 0.70 MEN1 (0.40) CHRNA7CHRNB2CHRNA4
SCHEMBL28526259 0.70 MEN1 (0.40) CHRNA7CHRNB2CHRNA4
SCHEMBL27397494 0.70 HTR1D (0.44) DRD2DRD1DRD4DRD5DRD3
SCHEMBL24737112 0.69 CHRNA7 (0.33) CHRNA7
SCHEMBL24774767 0.69 LIPG (0.38) CHRNA7DRD2HTR1A
SCHEMBL4825129 0.68 HTR1D (0.43) DRD2DRD1DRD4DRD5DRD3
Hydrochloric Acid SCHEMBL7994679 0.68 HTR1D (0.43) DRD2DRD1DRD4DRD5DRD3
SCHEMBL12932568 0.68 CHRNB2 (0.54) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4

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-2021083135-A1 Bcl-2 INHIBITORS BEIGENE, LTD. (KY) 2021-05-06 — — WO disclosed
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