SCHEMBL25617839

SCHEMBL25617839

Clc1ccc2[nH]c3c(c2c1)C=CC(c1cccc(-c2ccccc2)c1)C3

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.40
ROCK2 O75116 2/20 0.40
CSF1R P07333 2/20 0.40
MAPK1 P28482 2/20 0.40
GSK3A P49840 2/20 0.40
GSK3B P49841 2/20 0.40
LIMK1 P53667 2/20 0.40
STK3 Q13188 2/20 0.40
CDC42BPA Q5VT25 2/20 0.40
EGFR P00533 1/20 0.40
PRKACA P17612 1/20 0.40
PRKCD Q05655 1/20 0.40
ROCK1 Q13464 1/20 0.40
HTR2A P28223 2/20 0.40
HTR2C P28335 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
RXFP1 Q9HBX9 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MAP2 P11137 3/20 0.38

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
SCHEMBL21671134 0.78 TNKS2 (0.40) PIM1GSK3AGSK3BMEN1KMT2A
SCHEMBL25117604 0.75 DRD2 (0.41) MAPK1HTR2AHTR2CMEN1KMT2A
SCHEMBL25617930 0.72 EDNRA (0.34) HTR2CMEN1KMT2A
SCHEMBL17880964 0.69
SCHEMBL25616466 0.68 MAOA (0.34) MEN1KMT2AALDH1A1KDM4E
SCHEMBL25583541 0.67 MEN1 (0.58) PIM1ROCK2CSF1RMAPK1GSK3A
SCHEMBL25617626 0.67 MEN1 (0.58) PIM1ROCK2CSF1RMAPK1GSK3A
SCHEMBL25055370 0.66 CDC42 (0.39) PIM1ROCK2CSF1RMAPK1GSK3A
SCHEMBL21912934 0.65 SIRT2 (0.46) HTR2AHTR2CMEN1KMT2AALDH1A1
SCHEMBL21669083 0.65 FEN1 (0.35) GSK3B

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-4198020-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME, AND ELECTRONIC APPARATUS Shaanxi Lighte Optoelectronics Material Co., Ltd. (CN) 2023-06-21 EP disclosed