SCHEMBL21074272

SCHEMBL21074272

Cc1cc(C)cc(N2C=CN(c3c(C)ccc4c3oc3ccccc34)C2C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
LMNA P02545 3/20 0.33
RXFP1 Q9HBX9 3/20 0.33
PPARG P37231 2/20 0.33
NR2E3 Q9Y5X4 2/20 0.33
NCOR2 Q9Y618 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP2C19 P33261 1/20 0.32
PGR P06401 1/20 0.32
KDM4E B2RXH2 3/20 0.32
HPGD P15428 2/20 0.32
MAPT P10636 2/20 0.32
POLB P06746 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
SCHEMBL19999705 1.00 ALDH1A1 (0.33) ALDH1A1LMNARXFP1PPARGNR2E3
SCHEMBL20349245 0.89 ALDH1A1 (0.35) ALDH1A1LMNARXFP1PPARGNR2E3
SCHEMBL19999701 0.89 ALDH1A1 (0.35) ALDH1A1LMNARXFP1PPARGNR2E3
SCHEMBL11921030 0.89 ALDH1A1 (0.35) ALDH1A1LMNARXFP1PPARGNR2E3
SCHEMBL21074287 0.86 MEN1 (0.38) ALDH1A1LMNARXFP1PPARGNR2E3
SCHEMBL19999699 0.86 MEN1 (0.38) ALDH1A1LMNARXFP1PPARGNR2E3
SCHEMBL24469196 0.84 LMNA (0.36) ALDH1A1LMNARXFP1PIK3CDPIK3CA
SCHEMBL13843648 0.83 MEN1 (0.34) ALDH1A1LMNARXFP1PPARGNR2E3
SCHEMBL23613653 0.83 MEN1 (0.34) ALDH1A1LMNARXFP1PPARGNR2E3
SCHEMBL13878861 0.83 MEN1 (0.34) ALDH1A1LMNARXFP1PPARGNR2E3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3492480-B1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2021-10-20 EP disclosed
EP-3492480-A2 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2019-06-05 EP disclosed