SCHEMBL30496983

SCHEMBL30496983

Cc1c(CN)ccc2c1CN(C1CCCNC1)C2=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 2/20 0.43
▸ HTR2B P41595 14/20 0.41
▸ HTR2C P28335 13/20 0.41
▸ HTR2A P28223 12/20 0.41
▸ HTR3E A5X5Y0 1/20 0.40
▸ HTR3B O95264 1/20 0.40
▸ HTR3A P46098 1/20 0.40
▸ TMEM97 Q5BJF2 1/20 0.40
▸ HTR3D Q70Z44 1/20 0.40
▸ HTR3C Q8WXA8 1/20 0.40
▸ MAPK1 P28482 2/20 0.35
▸ CDK4 P11802 1/20 0.35
▸ TLR8 Q9NR97 1/20 0.33

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
SCHEMBL30496984 0.86 PARP1 (0.45) PARP1HTR2BHTR2CHTR2AHTR3E
SCHEMBL30496977 0.77 PARP1 (0.45) PARP1HTR2BHTR2CHTR2AHTR3E
SCHEMBL30459786 0.77 PARP1 (0.43) PARP1HTR2BHTR2CHTR2AHTR3E
SCHEMBL30936963 0.75 PARP1 (0.45) PARP1HTR2BHTR2CHTR2AHTR3E
SCHEMBL30698072 0.75 HTR2B (0.62) PARP1HTR2BHTR2CHTR2AHTR3E
SCHEMBL30376302 0.75 HTR2B (0.62) PARP1HTR2BHTR2CHTR2AHTR3E
SCHEMBL660471 0.75 HTR2B (0.62) PARP1HTR2BHTR2CHTR2AHTR3E
SCHEMBL2333387 0.74 HTR2B (0.49) PARP1HTR2BHTR2CHTR2AHTR3E
SCHEMBL30459956 0.74 HTR2B (0.50) PARP1HTR2BHTR2CHTR2AHTR3E
Hydrochloric Acid SCHEMBL28593152 0.74 HTR2B (0.60) PARP1HTR2BHTR2CHTR2AHTR3E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116457344-A Low molecular weight protein degradation agent and application thereof 凯普托尔治疗学股份有限公司 2023-07-18 — — CN disclosed
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