SCHEMBL28454648

SCHEMBL28454648

CCNc1ccccc1C(=O)N(CC)CC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 3/20 0.59
ADRA1D P25100 2/20 0.59
ADRA1B P35368 2/20 0.59
MAPT P10636 2/20 0.53
KEAP1 Q14145 1/20 0.49
ABCC1 P33527 1/20 0.49
TP53 P04637 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 2/20 0.47
MAPK1 P28482 1/20 0.46
KCNA5 P22460 1/20 0.46
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
GHSR Q92847 1/20 0.44
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44
NPC1 O15118 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
CDK5 Q00535 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
SCHEMBL27752030 0.84 ADRA1A (0.57) ADRA1AADRA1DADRA1BMAPTKEAP1
SCHEMBL28455283 0.84 ADRA1D (0.56) ADRA1AADRA1DADRA1BMAPTKEAP1
SCHEMBL610480 0.81 TP53 (0.69) ADRA1AADRA1DADRA1BMAPTKEAP1
SCHEMBL29822323 0.81 TP53 (0.69) ADRA1AADRA1DADRA1BMAPTKEAP1
SCHEMBL14349252 0.80 MAPT (0.57) ADRA1AADRA1DADRA1BMAPTKEAP1
SCHEMBL7223562 0.80 MAPT (0.51) ADRA1AADRA1DADRA1BMAPTKEAP1
SCHEMBL2001238 0.80 FABP4 (0.48) ADRA1AADRA1DADRA1BTSHRALDH1A1
SCHEMBL14960124 0.79 KMT2A (0.56) ADRA1AADRA1DADRA1BMAPTKEAP1
SCHEMBL6088062 0.78 JAK2 (0.48) ADRA1AADRA1DADRA1BALDH1A1HPGD
SCHEMBL184136 0.78 ALDH1A1 (0.62) ABCC1SMN1; SMN2ALDH1A1HPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114516855-A Preparation of pyridylpyrazole amide compounds and intermediates therefor 湖南化工研究院有限公司 2022-05-20 CN claimed
CN-114516854-A Preparation method of 1-pyridyl pyrazole amide compound and intermediate thereof 湖南化工研究院有限公司 2022-05-20 CN claimed
CN-111662269-B 1-pyridyl pyrazole amide compound and preparation method and application thereof 湖南化工研究院有限公司 2021-05-07 CN claimed
CN-111662269-A 1-pyridyl pyrazole amide compound and preparation method and application thereof 湖南化工研究院有限公司 2020-09-15 CN claimed
CN-114516855-A Preparation of pyridylpyrazole amide compounds and intermediates therefor 湖南化工研究院有限公司 2022-05-20 CN disclosed
CN-114516854-A Preparation method of 1-pyridyl pyrazole amide compound and intermediate thereof 湖南化工研究院有限公司 2022-05-20 CN disclosed
CN-111662269-B 1-pyridyl pyrazole amide compound and preparation method and application thereof 湖南化工研究院有限公司 2021-05-07 CN disclosed
CN-111662269-A 1-pyridyl pyrazole amide compound and preparation method and application thereof 湖南化工研究院有限公司 2020-09-15 CN disclosed