SCHEMBL29647857

SCHEMBL29647857

Brc1cccc(-c2nnc3c4ccccc4c4ccccc4n23)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.63
ALDH1A1 P00352 3/20 0.43
MAPT P10636 5/20 0.41
HPGD P15428 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
TSHR P16473 2/20 0.40
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RXFP1 Q9HBX9 3/20 0.40
KDM4E B2RXH2 2/20 0.40
TP53 P04637 2/20 0.40
HTT P42858 1/20 0.40
TYMS P04818 1/20 0.40
PARP1 P09874 1/20 0.39
G6PD P11413 1/20 0.39
PKM P14618 1/20 0.39
ALOX12 P18054 1/20 0.39
HKDC1 Q2TB90 1/20 0.39

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
SCHEMBL515063 1.00 POLB (0.63) POLBALDH1A1MAPTHPGDNPC1
SCHEMBL10128453 0.97 POLB (0.60) POLBALDH1A1MAPTHPGDNPC1
SCHEMBL10128455 0.93 POLB (0.56) POLBALDH1A1MAPTHPGDNPC1
SCHEMBL10128446 0.84 POLB (0.52) POLBALDH1A1MAPTHPGDNPC1
SCHEMBL10128840 0.84 POLB (0.52) POLBALDH1A1MAPTHPGDNPC1
SCHEMBL515316 0.84 POLB (0.53) POLBALDH1A1MAPTHPGDNPC1
SCHEMBL515190 0.83 POLB (0.50) POLBALDH1A1MAPTHPGDNPC1
SCHEMBL10128634 0.83 POLB (0.63) POLBALDH1A1MAPTHPGDNPC1
SCHEMBL10128449 0.82 POLB (0.52) POLBALDH1A1MAPTHPGDNPC1
SCHEMBL516347 0.82 POLB (0.62) POLBALDH1A1MAPTHPGDNPC1

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-2022090863-A1 ORGANIC COMPOUND, CARRIER TRANSPORT MATERIAL, HOST MATERIAL, LIGHT EMITTING DEVICE, LIGHT EMITTING APPARATUS, ELECTRONIC EQUIPMENT, AND LIGHTING APPARATUS 株式会社半導体エネルギー研究所 2022-05-05 WO disclosed