SCHEMBL29776341

SCHEMBL29776341

Brc1ccc(-c2c3ccccc3c(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccccc23)cn1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.37
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
OPRK1 P41145 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.33
PDK2 Q15119 4/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 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
SCHEMBL20167830 1.00 L3MBTL1 (0.37) L3MBTL1KDM4EMEN1LMNAMAPT
SCHEMBL20167731 0.92 L3MBTL1 (0.40) L3MBTL1NPSR1PDK2
SCHEMBL26161307 0.88 PDK2 (0.36) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL20176790 0.86 L3MBTL1 (0.31) L3MBTL1
SCHEMBL5557792 0.85 MEN1 (0.39) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL29776442 0.84 L3MBTL1 (0.35) L3MBTL1PDK2
SCHEMBL20167922 0.84 L3MBTL1 (0.35) L3MBTL1PDK2
SCHEMBL25474047 0.84 MEN1 (0.42) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL20167558 0.83 L3MBTL1 (0.33) L3MBTL1NPSR1
SCHEMBL19862726 0.83 PDK2 (0.36) KDM4EMEN1LMNAMAPTOPRK1

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-110023305-B Organic light-emitting compound and organic electroluminescent element using same 索路思高新材料有限公司 2022-08-09 CN disclosed