SCHEMBL29941741

SCHEMBL29941741

Clc1cccc2c(-c3c[nH]cc3-c3c[nH]c4c(Cl)cccc34)c[nH]c12

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 2/20 0.54
▸ DYRK1A Q13627 3/20 0.51
▸ NR4A2 P43354 1/20 0.49
▸ HTR2A P28223 1/20 0.49
▸ SLC6A4 P31645 2/20 0.43
▸ RIPK1 Q13546 3/20 0.40
▸ TDO2 P48775 1/20 0.40
▸ DAO P14920 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2A6 P11509 1/20 0.39
▸ PCSK9 Q8NBP7 1/20 0.39
▸ CHEK1 O14757 1/20 0.39
▸ FLT3 P36888 1/20 0.39
▸ PLK3 Q9H4B4 1/20 0.39
▸ AHR P35869 1/20 0.38

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
SCHEMBL15617048 0.79 DYRK1A (0.57) ARDYRK1ANR4A2HTR2ASLC6A4
SCHEMBL28251367 0.77 DYRK1A (0.60) ARDYRK1ANR4A2HTR2ASLC6A4
SCHEMBL21067626 0.74 NR4A2 (0.47) ARDYRK1ANR4A2HTR2A
SCHEMBL4078677 0.72 DYRK1A (0.55) ARDYRK1ANR4A2HTR2ASLC6A4
SCHEMBL19836839 0.72 DYRK1A (0.55) ARDYRK1ANR4A2HTR2ASLC6A4
SCHEMBL15617054 0.72 DYRK1A (0.55) ARDYRK1ANR4A2HTR2ASLC6A4
SCHEMBL25293100 0.72 HTR2A (0.49) ARDYRK1ANR4A2HTR2ASLC6A4
SCHEMBL30548044 0.72 HTR2A (0.49) ARDYRK1ANR4A2HTR2ASLC6A4
SCHEMBL2036977 0.72 NR4A2 (0.69) DYRK1ANR4A2HTR2A
SCHEMBL31542356 0.72 NR4A2 (0.69) DYRK1ANR4A2HTR2A

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
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 — — US disclosed
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