SCHEMBL25919679

SCHEMBL25919679

Cc1ccc2c(c1)c1ccccc1n2-c1ccccc1-c1ccccc1-n1c2ccc(C)cc2c2cc(C)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
ALDH1A1 P00352 3/20 0.41
MAPT P10636 5/20 0.40
LMNA P02545 4/20 0.40
HTT P42858 3/20 0.40
PGR P06401 1/20 0.39
RORA P35398 1/20 0.39
RORC P51449 1/20 0.39
RORB Q92753 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDO2 P48775 1/20 0.38
IDO2 Q6ZQW0 1/20 0.38
KDM4E B2RXH2 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ATM Q13315 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37

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
SCHEMBL26226118 1.00 BCHE (0.43) BCHEACHEALDH1A1MAPTLMNA
SCHEMBL25692995 0.95 BCHE (0.43) BCHEACHEALDH1A1MAPTLMNA
SCHEMBL25875166 0.92 KDM4E (0.41) BCHEACHEALDH1A1MAPTLMNA
SCHEMBL25875158 0.92 KDM4E (0.41) BCHEACHEALDH1A1MAPTLMNA
SCHEMBL26226116 0.92 KDM4E (0.41) BCHEACHEALDH1A1MAPTLMNA
SCHEMBL26519480 0.92 KDM4E (0.41) BCHEACHEALDH1A1MAPTLMNA
SCHEMBL27058765 0.92 KDM4E (0.41) BCHEACHEALDH1A1MAPTLMNA
SCHEMBL5812206 0.91 BCHE (0.43) BCHEACHEALDH1A1MAPTLMNA
SCHEMBL26481413 0.90 ALDH1A1 (0.41) BCHEACHEALDH1A1MAPTLMNA
SCHEMBL26340818 0.90 ALDH1A1 (0.41) BCHEACHEALDH1A1MAPTLMNA

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-2023142485-A1 BORON-NITROGEN COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 季华恒烨(佛山)电子材料有限公司 2023-08-03 WO disclosed