SCHEMBL26047752

SCHEMBL26047752

CC(C)(C)c1ccc2cc3ccc(-c4ccc5c6ccccc6n(C(C)(C)C)c5c4)cc3cc2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.36
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
METAP2 P50579 2/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32
TUBB3 Q13509 1/20 0.32
TUBB2A Q13885 1/20 0.32

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
SCHEMBL22327517 0.83 KIF11 (0.44) KIF11ALDH1A1MAPTMEN1KMT2A
SCHEMBL24617586 0.83 KIF11 (0.47) KIF11ALDH1A1MAPTMEN1KMT2A
SCHEMBL24775133 0.82 ALDH1A1 (0.41) KIF11ALDH1A1MAPTMEN1KMT2A
SCHEMBL25685906 0.78 RXRA (0.44) KIF11KMT2AKDM4ELMNARXRA
SCHEMBL30416289 0.78 KIF11 (0.47) KIF11ALDH1A1MAPTMEN1KMT2A
SCHEMBL25671071 0.78 KIF11 (0.47) KIF11ALDH1A1MAPTMEN1KMT2A
SCHEMBL25721709 0.77 PGR (0.33) KIF11PGRRORARORCRORB
SCHEMBL13762048 0.76 SERPINE1 (0.37) KIF11ALDH1A1MAPTRXRARXRB
SCHEMBL13762047 0.76 SERPINE1 (0.37) KIF11ALDH1A1MAPTRXRARXRB
SCHEMBL25710918 0.75 KDM4E (0.39) KIF11ALDH1A1MAPTMEN1KMT2A

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-11744145-B2 Organic compound and organic electroluminescent device comprising the same LG DISPLAY CO., LTD. (KR) 2023-08-29 US disclosed