SCHEMBL29135049

SCHEMBL29135049

Clc1cccc(-c2cnc(-c3ccccc3)c(-c3ccccc3)n2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 6/20 0.54
ADORA2A P29274 4/20 0.54
IDO1 P14902 2/20 0.50
ATR Q13535 1/20 0.49
CNR2 P34972 1/20 0.47
KMO O15229 2/20 0.47
SCN2A Q99250 1/20 0.46
ADORA2B P29275 1/20 0.46
CKS1B P61024 1/20 0.44
SKP1 P63208 1/20 0.44
SKP2 Q13309 1/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
NFKB1 P19838 1/20 0.44
RAB9A P51151 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL30708981 1.00 ADORA1 (0.54) ADORA1ADORA2AIDO1ATRCNR2
SCHEMBL30708988 0.97 ADORA1 (0.51) ADORA1ADORA2AIDO1ATRCNR2
SCHEMBL30775125 0.92 ADORA1 (0.50) ADORA1ADORA2AIDO1ATRSCN2A
SCHEMBL29134696 0.92 ADORA1 (0.50) ADORA1ADORA2AIDO1ATRSCN2A
SCHEMBL31468261 0.87 ADORA1 (0.43) ADORA1ADORA2AIDO1ATRCNR2
SCHEMBL31468254 0.83 ADORA2A (0.42) ADORA1ADORA2AIDO1ATRSCN2A
SCHEMBL22911636 0.83 L3MBTL1 (0.59) ADORA1ADORA2AATRSCN2ACKS1B
SCHEMBL31468247 0.83 ADORA2A (0.40) ADORA1ADORA2AIDO1ATRCNR2
SCHEMBL87574 0.82 CKS1B (0.55) ATRCKS1BSKP1SKP2NPC1
SCHEMBL29135048 0.81 CYP2A6 (0.46) ADORA1ADORA2ACKS1BSKP1SKP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025048507-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 솔루스첨단소재 주식회사 2025-03-06 WO disclosed
CN-117343102-A Compound, organic electroluminescent device and display device SK株式会社 2024-01-05 CN disclosed
CN-116903548-A Compound, composition for organic electroluminescent device, and display device SK株式会社 2023-10-20 CN disclosed