SCHEMBL24726804

SCHEMBL24726804

C=CCc1c[nH]c2ccc(C)cc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 7/20 0.63
HTR2A P28223 7/20 0.63
HTR1B P28222 6/20 0.63
HTR1A P08908 5/20 0.63
ADRA2A P08913 5/20 0.63
ADRA2B P18089 5/20 0.63
ADRA2C P18825 5/20 0.63
HTR2C P28335 5/20 0.63
HTR1E P28566 5/20 0.63
SLC6A4 P31645 5/20 0.63
HTR7 P34969 5/20 0.63
HRH1 P35367 5/20 0.63
DRD3 P35462 5/20 0.63
OPRK1 P41145 5/20 0.63
HTR2B P41595 5/20 0.63
HTR5A P47898 5/20 0.63
HTR6 P50406 5/20 0.63
SLC6A3 Q01959 5/20 0.63
SIGMAR1 Q99720 5/20 0.63
DRD2 P14416 4/20 0.63

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
SCHEMBL18383116 0.80 HTR1D (0.69) HTR1DHTR2AHTR1BHTR1AADRA2A
SCHEMBL3773674 0.80 GPR84 (0.67) HTR1DHTR2AHTR1BHTR1AADRA2A
SCHEMBL7651463 0.79 HTR1D (0.67) HTR1DHTR2AHTR1BHTR1AADRA2A
SCHEMBL22462305 0.78 HTR1D (1.00) HTR1DHTR2AHTR1BHTR1AADRA2A
SCHEMBL27504320 0.78 HTR1D (0.71) HTR1DHTR2AHTR1BHTR1AADRA2A
SCHEMBL1722931 0.77 HTR1D (0.65) HTR1DHTR2AHTR1BHTR1AADRA2A
SCHEMBL31567644 0.77 HTR1D (0.65) HTR1DHTR2AHTR1BHTR1AADRA2A
SCHEMBL24692975 0.77 HTR2A (0.79) HTR1DHTR2AHTR1BHTR1AADRA2A
SCHEMBL3052894 0.76 HTR2A (0.55) HTR1DHTR2AHTR1BHTR1AADRA2A
SCHEMBL3047574 0.76 HTR2A (0.55) HTR1DHTR2AHTR1BHTR1AADRA2A

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-2022211518-A1 NOVEL COMPOUND AND USE THEREOF IN TREATING PSORIASIS, ASTHMA, OR SYSTEMIC LUPUS ERYTHEMATOSUS 파렌키마바이오텍 주식회사 2022-10-06 WO disclosed