SCHEMBL30221171

SCHEMBL30221171

Brc1ccc2c(c1)[nH]c1ccc3ccccc3c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 10/20 0.51
CCND1 P24385 10/20 0.51
CCNB2 O95067 3/20 0.48
CCNE2 O96020 3/20 0.48
CDK1 P06493 3/20 0.48
CCNB1 P14635 3/20 0.48
CCNE1 P24864 3/20 0.48
CDK2 P24941 3/20 0.48
CCNB3 Q8WWL7 3/20 0.48
CAMK2B Q13554 2/20 0.48
CAMK2G Q13555 2/20 0.48
CAMK2D Q13557 2/20 0.48
CAMK2A Q9UQM7 2/20 0.48
CCNT1 O60563 1/20 0.48
EIF2AK2 P19525 1/20 0.48
CCNA2 P20248 1/20 0.48
CDK9 P50750 1/20 0.48
CDK5 Q00535 1/20 0.48
CDK5R1 Q15078 1/20 0.48
CYP2A6 P11509 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
SCHEMBL31622 1.00 CDK4 (0.51) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL30849130 1.00 CDK4 (0.51) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL10044741 0.88 CDK4 (0.53) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL15848788 0.87 CDK4 (0.46) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL16536115 0.87 CDK4 (0.55) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL16536029 0.85 CDK4 (0.66) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL2627633 0.84 CDK4 (0.52) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL17841968 0.84 CDK4 (0.49) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL13828829 0.83 CDK4 (0.59) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL12219467 0.82 CDK4 (0.56) CDK4CCND1CCNB2CCNE2CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119775285-A Organic compound, organic electroluminescent device and electronic device 陕西莱特光电材料股份有限公司 2025-04-08 CN disclosed
CN-117777137-A Organic compound, organic electroluminescent device and electronic device 陕西莱特光电材料股份有限公司 2024-03-29 CN disclosed
CN-117466896-A Organic compound, organic electroluminescent device and electronic device 陕西莱特光电材料股份有限公司 2024-01-30 CN disclosed
CN-110024155-B Organic light emitting device 株式会社LG化学 2023-07-04 CN disclosed
CN-111675697-B Organic electroluminescent material and device thereof 北京夏禾科技有限公司 2023-02-03 CN disclosed