SCHEMBL31055005

SCHEMBL31055005

C=CC=Cc1cccc2c1CC2

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.32
ADRA2B P18089 2/20 0.32
ADRA2C P18825 2/20 0.32
BCL2L1 Q07817 1/20 0.31
BAD Q92934 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
SCHEMBL9098503 0.83 BCL2L1 (0.37) ADRA2AADRA2BADRA2CBCL2L1BAD
SCHEMBL4595232 0.79 ALDH1A1 (0.38) ADRA2AADRA2BADRA2CBCL2L1BAD
SCHEMBL31462459 0.78 BCL2L1 (0.33) ADRA2AADRA2BADRA2CBCL2L1BAD
SCHEMBL31462448 0.72 ALDH1A1 (0.30) ADRA2AADRA2BADRA2C
SCHEMBL23838467 0.69 ALDH1A1 (0.39)
SCHEMBL9478055 0.69 NFE2L2 (0.50)
SCHEMBL9478053 0.69 NFE2L2 (0.50)
SCHEMBL19050199 0.69
SCHEMBL9136887 0.68 BCL2L1 (0.50) BCL2L1BAD
SCHEMBL26568474 0.67 PTPN1 (0.31)

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
CN-118459642-A Negative photosensitive resin composition containing benzocyclobutene structure, and preparation method and application thereof 武汉迪赛新材料有限公司 2024-08-09 CN claimed
CN-118459642-A Negative photosensitive resin composition containing benzocyclobutene structure, and preparation method and application thereof 武汉迪赛新材料有限公司 2024-08-09 CN disclosed
CN-118459642-A Negative photosensitive resin composition containing benzocyclobutene structure, and preparation method and application thereof 武汉迪赛新材料有限公司 2024-08-09 CN disclosed