SCHEMBL23920487

SCHEMBL23920487

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc5oc6ccc7oc8ccc9oc%10c%11ccccc%11c3c3c%10c9c8c7c6c5c34)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.34
ALDH1A1 P00352 5/20 0.34
TSHR P16473 4/20 0.34
HPGD P15428 1/20 0.34
LMNA P02545 4/20 0.33
KMT2A Q03164 3/20 0.33
POLB P06746 2/20 0.33
HTT P42858 1/20 0.33
PIK3CA P42336 1/20 0.33
KDM4E B2RXH2 3/20 0.32
HSD17B10 Q99714 2/20 0.32
MAPK1 P28482 1/20 0.32
MEN1 O00255 2/20 0.32
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
USP2 O75604 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL23920654 0.95 MAPT (0.34) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL20315753 0.83 MAPT (0.34) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL23874714 0.83 L3MBTL1 (0.40) MAPTALDH1A1HPGDLMNAKMT2A
SCHEMBL20315762 0.81 MAPT (0.33) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL23874712 0.81 TSHR (0.35) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL20315770 0.81 ALDH1A1 (0.34) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL17451671 0.81 MAPT (0.39) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL16437637 0.80 TSHR (0.42) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL23920655 0.79 TERT (0.31) MAPTALDH1A1TSHRHPGDHSD17B10
SCHEMBL19786556 0.79 CYP1A1 (0.36) MAPTALDH1A1TSHRHPGDLMNA

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-20210320263-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-14 US disclosed