SCHEMBL23959613

SCHEMBL23959613

c1ccc(-c2ccccc2Nc2ccc3c(c2)C2(c4ccccc4-3)C3CC4CCCC2C(C4)C3)cc1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 1/20 0.32
OPRM1 P35372 1/20 0.32
PDK2 Q15119 1/20 0.31

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
SCHEMBL22797215 0.85 MEN1 (0.36) MEN1KMT2ANPSR1
SCHEMBL22797234 0.83 MEN1 (0.39) MEN1KMT2ANPSR1ALDH1A1PDK2
SCHEMBL25457925 0.82 ALDH1A1 (0.32) MEN1KMT2ANPSR1ALDH1A1PDK2
SCHEMBL22797350 0.81 MEN1 (0.38) MEN1KMT2ANPSR1PDK2
SCHEMBL22797441 0.80 PDK2 (0.40) PDK2
SCHEMBL22799520 0.79 PDK2 (0.36) MEN1KMT2ANPSR1PDK2
SCHEMBL23628259 0.79 MAPK14 (0.38) MEN1KMT2APDK2
SCHEMBL23959609 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL25458068 0.77 MEN1 (0.39) MEN1KMT2ANPSR1ALDH1A1PDK2
SCHEMBL22797220 0.77 MEN1 (0.39) MEN1KMT2ANPSR1ALDH1A1PDK2

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-2021213109-A1 ARYLAMINE COMPOUND, ELECTRONIC COMPONENT USING SAME AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 (CN) 2021-10-28 WO disclosed