SCHEMBL28891102

SCHEMBL28891102

CCCCCCCCCCc1ccc(-c2cccc3cc4ccccc4cc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.48
GPR3 P46089 1/20 0.46
CTSV O60911 1/20 0.45
CTSL P07711 1/20 0.45
RARB P10826 6/20 0.44
HSD11B1 P28845 2/20 0.43
HSD17B10 Q99714 2/20 0.43
TSHR P16473 1/20 0.43
ESR1 P03372 2/20 0.42
ADRA2A P08913 2/20 0.42
ADORA3 P0DMS8 2/20 0.42
TACR2 P21452 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
SHBG P04278 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL27730560 1.00 TLR8 (0.48) TLR8GPR3CTSVCTSLRARB
SCHEMBL28382831 1.00 TLR8 (0.48) TLR8GPR3CTSVCTSLRARB
SCHEMBL6059713 0.99 TLR8 (0.49) TLR8GPR3CTSVCTSLRARB
Anthracene SCHEMBL28891105 0.83 ESR1 (0.59) GPR3HSD17B10ESR1ADRA2AADORA3
SCHEMBL3728181 0.82 CTSV (0.49) CTSVCTSLRARBHSD11B1HSD17B10
SCHEMBL3724388 0.82 CTSV (0.49) CTSVCTSLRARBHSD11B1HSD17B10
SCHEMBL5551753 0.82 CYP1A2 (0.48) TLR8CTSVCTSLALDH1A1LMNA
SCHEMBL5551487 0.81 RARB (0.41) GPR3CTSVCTSLRARBHSD11B1
SCHEMBL5548833 0.79 THRB (0.41) TLR8GPR3CTSVCTSLRARB
SCHEMBL6059665 0.79 CTSV (0.49) CTSVCTSLRARBHSD11B1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116096127-A Laminated light-emitting field effect transistor and preparation method and application thereof 中国科学院化学研究所 2023-05-09 CN claimed
CN-116096126-A Planar light-emitting transistor for surface light source emergent and preparation method and application thereof 中国科学院化学研究所 2023-05-09 CN claimed
CN-115036424-A Polarized photoelectric detector based on organic semiconductor material and preparation method and application thereof 中国科学院化学研究所 2022-09-09 CN claimed
CN-116096126-A Planar light-emitting transistor for surface light source emergent and preparation method and application thereof 中国科学院化学研究所 2023-05-09 CN disclosed
CN-116096127-A Laminated light-emitting field effect transistor and preparation method and application thereof 中国科学院化学研究所 2023-05-09 CN disclosed
CN-115036424-A Polarized photoelectric detector based on organic semiconductor material and preparation method and application thereof 中国科学院化学研究所 2022-09-09 CN disclosed