SCHEMBL24929388

SCHEMBL24929388

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)sc3cccc(-c5ccc(-c6cccc7oc8ccccc8c67)c6oc7ccccc7c56)c34)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRDT Q58F21 1/20 0.37
ALOX5 P09917 2/20 0.34
MAPT P10636 9/20 0.34
ALDH1A1 P00352 7/20 0.33
TSHR P16473 4/20 0.33
KDM4E B2RXH2 4/20 0.33
POLB P06746 3/20 0.33
HPGD P15428 3/20 0.33
NPSR1 Q6W5P4 2/20 0.33
CDC14B O60729 1/20 0.33
CDC14A Q9UNH5 1/20 0.33
LMNA P02545 5/20 0.32
KMT2A Q03164 4/20 0.32
HSD17B10 Q99714 3/20 0.32
USP2 O75604 1/20 0.32
HTT P42858 1/20 0.32
MEN1 O00255 3/20 0.31
MAPK1 P28482 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL24929363 0.98 BRDT (0.39) BRDTALOX5MAPTALDH1A1TSHR
SCHEMBL26217052 0.97 BRDT (0.36) BRDTALOX5MAPTALDH1A1TSHR
SCHEMBL24929395 0.96 ALOX5 (0.40) BRDTALOX5MAPTALDH1A1TSHR
SCHEMBL26763696 0.96 BRDT (0.36) BRDTALOX5MAPTALDH1A1TSHR
SCHEMBL26220542 0.96 BRDT (0.36) BRDTALOX5MAPTALDH1A1TSHR
SCHEMBL26216964 0.96 CDC14B (0.37) BRDTALOX5MAPTALDH1A1TSHR
SCHEMBL24929506 0.95 BRDT (0.38) BRDTALOX5MAPTALDH1A1TSHR
SCHEMBL26220540 0.95 CDC14B (0.36) BRDTALOX5MAPTALDH1A1TSHR
SCHEMBL25458075 0.94 BRDT (0.35) BRDTALOX5MAPTALDH1A1TSHR
SCHEMBL26223987 0.94 BRDT (0.35) BRDTALOX5MAPTALDH1A1TSHR

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-2023008795-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2023-02-02 WO disclosed