SCHEMBL25860926

SCHEMBL25860926

CC1C=CC=CC1c1cc(-c2ccccc2)cc(-c2cc(-c3ccccc3)c3cc(-c4ccc5nc(-c6cc(-c7ccccc7)cc(-c7ccccc7)c6)cc(-c6ccccc6)c5c4)ccc3n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
LMNA P02545 4/20 0.41
NPSR1 Q6W5P4 3/20 0.41
KDM4E B2RXH2 3/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
AURKA O14965 1/20 0.40
AURKB Q96GD4 1/20 0.40
ACACA Q13085 3/20 0.40
MAPK1 P28482 2/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
HPGD P15428 4/20 0.38
HSP90AA1 P07900 3/20 0.38
PIK3CA P42336 1/20 0.37
ELANE P08246 2/20 0.37
THRB P10828 3/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL19953853 0.81 ALDH1A1 (0.53) ALDH1A1LMNANPSR1KDM4EMAPT
SCHEMBL13774335 0.75 ALDH1A1 (0.59) ALDH1A1LMNANPSR1KDM4EMAPT
SCHEMBL19953850 0.75 ALDH1A1 (0.59) ALDH1A1LMNANPSR1KDM4EMAPT
SCHEMBL19618369 0.74 ALDH1A1 (0.55) ALDH1A1LMNANPSR1KDM4EMAPT
SCHEMBL19618340 0.74 ALDH1A1 (0.55) ALDH1A1LMNANPSR1KDM4EMAPT
SCHEMBL19618344 0.74 ALDH1A1 (0.55) ALDH1A1LMNANPSR1KDM4EMAPT
SCHEMBL19618420 0.74 ALDH1A1 (0.55) ALDH1A1LMNANPSR1KDM4EMAPT
SCHEMBL14666153 0.73 ALDH1A1 (0.61) ALDH1A1LMNANPSR1KDM4EMAPT
SCHEMBL19618403 0.73 ALDH1A1 (0.51) ALDH1A1LMNANPSR1KDM4EMAPT
SCHEMBL19618402 0.73 ALDH1A1 (0.51) ALDH1A1LMNANPSR1KDM4EMAPT

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
EP-3639308-B1 ORGANIC ELECTROLUMINESCENT DEVICE SAMSUNG DISPLAY CO LTD (KR) 2023-07-26 EP disclosed