SCHEMBL30886892

SCHEMBL30886892

CCN(C(=O)C1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1)C(C)C

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 11/20 0.80
▸ HTR2C P28335 2/20 0.80
▸ ADRB2 P07550 1/20 0.80
▸ ADRB1 P08588 1/20 0.80
▸ HTR1A P08908 1/20 0.80
▸ DRD2 P14416 1/20 0.80
▸ DRD4 P21917 1/20 0.80
▸ DRD5 P21918 1/20 0.80
▸ HTR1D P28221 1/20 0.80
▸ HTR1E P28566 1/20 0.80
▸ HTR7 P34969 1/20 0.80
▸ HRH1 P35367 1/20 0.80
▸ DRD3 P35462 1/20 0.80
▸ HTR2B P41595 1/20 0.80
▸ HTR5A P47898 1/20 0.80
▸ HTR6 P50406 1/20 0.80
▸ KDM4E B2RXH2 1/20 0.67
▸ MEN1 O00255 1/20 0.67
▸ USP2 O75604 1/20 0.67
▸ MAPT P10636 1/20 0.67

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
SCHEMBL30886886 1.00 HTR2A (0.80) HTR2AHTR2CADRB2ADRB1HTR1A
SCHEMBL20970933 1.00 HTR2A (0.80) HTR2AHTR2CADRB2ADRB1HTR1A
SCHEMBL1884075 0.93 HTR2A (0.77) HTR2AHTR2CADRB2ADRB1HTR1A
Hydrochloric Acid SCHEMBL1889935 0.92 HTR2A (0.76) HTR2AHTR2CADRB2ADRB1HTR1A
SCHEMBL25545361 0.91 HTR2A (0.72) HTR2AHTR2CADRB2ADRB1HTR1A
SCHEMBL25545356 0.91 HTR2A (0.71) HTR2AHTR2CADRB2ADRB1HTR1A
SCHEMBL30298978 0.91 HTR2A (0.71) HTR2AHTR2CADRB2ADRB1HTR1A
Lysergide SCHEMBL28097238 0.90 HTR2A (0.94) HTR2AHTR2CADRB2ADRB1HTR1A
Lysergide SCHEMBL28318015 0.90 HTR2A (0.94) HTR2AHTR2CADRB2ADRB1HTR1A
Lysergide SCHEMBL24449764 0.89 HTR2A (1.00) HTR2AHTR2CADRB2ADRB1HTR1A

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
CN-118055766-A Magic and non-magic serotonin receptor agonist and its preparing process and usage 库莱恩有限责任公司 2024-05-17 — — CN disclosed
Send feedback