SCHEMBL23028874

SCHEMBL23028874

Clc1ccc2c(c1)Sc1cccc3c1C2(c1ccccc1)c1ccccc1-3

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.38
ACHE P22303 3/20 0.38
BCHE P06276 2/20 0.38
NOX1 Q9Y5S8 1/20 0.38
GPR84 Q9NQS5 2/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 3/20 0.35
OPRK1 P41145 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C19 P33261 2/20 0.34
MTOR P42345 1/20 0.34
TP53 P04637 1/20 0.34
NFKB1 P19838 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL23028920 0.85 SMN1; SMN2 (0.42) PDK2ACHEBCHENOX1MEN1
SCHEMBL23372318 0.85 PDK2 (0.44) PDK2ACHEBCHENOX1GPR84
SCHEMBL23697271 0.85 ACHE (0.44) PDK2ACHEBCHENOX1GPR84
SCHEMBL23028823 0.85 MEN1 (0.43) PDK2ACHEBCHENOX1MEN1
SCHEMBL23028877 0.84 MEN1 (0.36) PDK2ACHEBCHENOX1GPR84
SCHEMBL23208383 0.82 PDK2 (0.41) PDK2ACHEBCHENOX1GPR84
SCHEMBL23372316 0.79 PDK2 (0.51) PDK2ACHEBCHENOX1GPR84
SCHEMBL23382843 0.78 PDK2 (0.40) PDK2ACHEBCHENOX1GPR84
SCHEMBL25125687 0.77 PDK2 (0.56) PDK2MEN1KMT2ALMNAOPRK1
SCHEMBL23028824 0.77 MEN1 (0.42) PDK2BCHEMEN1KMT2ALMNA

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-2021034089-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-25 WO disclosed