SCHEMBL29237588

SCHEMBL29237588

C[C@@H](OCc1ccccc1)C(=O)N1Cc2ccc(Br)cc2C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP8 Q6V1X1 4/20 0.54
▸ DPP7 Q9UHL4 4/20 0.54
▸ DPP9 Q86TI2 3/20 0.54
▸ ABHD6 Q9BV23 3/20 0.44
▸ TMEM97 Q5BJF2 5/20 0.44
▸ SIGMAR1 Q99720 5/20 0.44
▸ HRH1 P35367 2/20 0.44
▸ HRH3 Q9Y5N1 2/20 0.44
▸ HTR1A P08908 1/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ ADRA2B P18089 1/20 0.44
▸ ADRA2C P18825 1/20 0.44
▸ DRD1 P21728 1/20 0.44
▸ HRH2 P25021 1/20 0.44
▸ HTR1B P28222 1/20 0.44
▸ HTR2A P28223 1/20 0.44
▸ HTR2C P28335 1/20 0.44
▸ HTR1E P28566 1/20 0.44
▸ SLC6A4 P31645 1/20 0.44
▸ HTR2B P41595 1/20 0.44

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
SCHEMBL29237591 1.00 DPP8 (0.54) DPP8DPP7DPP9ABHD6TMEM97
SCHEMBL30967882 1.00 DPP8 (0.54) DPP8DPP7DPP9ABHD6TMEM97
SCHEMBL31129893 0.79 TMEM97 (0.63) ABHD6TMEM97SIGMAR1HRH1HRH3
SCHEMBL7005876 0.79 TMEM97 (0.63) ABHD6TMEM97SIGMAR1HRH1HRH3
SCHEMBL30217207 0.78 TMEM97 (0.37) DPP8DPP7DPP9TMEM97SIGMAR1
SCHEMBL25258146 0.76 DPP7 (0.66) DPP8DPP7DPP9ABHD6NAMPT
SCHEMBL20336588 0.75 HPGD (0.49) DPP7DPP4
SCHEMBL20336587 0.75 HPGD (0.49) DPP7DPP4
SCHEMBL31432958 0.75 DPP8 (0.62) DPP8DPP7DPP9ABHD6DPP4
SCHEMBL31432838 0.75 DPP8 (0.62) DPP8DPP7DPP9ABHD6DPP4

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-118201919-A Indole compounds and methods of use 健赞公司 2024-06-14 — — CN disclosed
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