SCHEMBL4283947

SCHEMBL4283947

CN1CCN(C(=O)OC2CCNCC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 9/20 0.51
TPSD1 Q9BZJ3 9/20 0.51
TPSG1 Q9NRR2 9/20 0.51
KDM1A O60341 1/20 0.40
CYP1A2 P05177 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HRH3 Q9Y5N1 4/20 0.39
HTT P42858 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL22018450 0.87 CYP1A2 (0.46) TPSAB1TPSD1TPSG1CYP1A2TDP1
SCHEMBL17479229 0.85 TPSAB1 (0.52) TPSAB1TPSD1TPSG1KDM1A
SCHEMBL22018451 0.84 TPSAB1 (0.50) TPSAB1TPSD1TPSG1HTT
SCHEMBL21428432 0.84 LMNA (0.47) TPSAB1TPSD1TPSG1CYP1A2TDP1
SCHEMBL26124912 0.84 TPSAB1 (0.55) TPSAB1TPSD1TPSG1KDM1A
SCHEMBL28067576 0.84 TPSAB1 (0.55) TPSAB1TPSD1TPSG1KDM1A
SCHEMBL25565794 0.83 TPSAB1 (0.48) TPSAB1TPSD1TPSG1KDM1AHRH3
SCHEMBL21428419 0.82 LMNA (0.50) TPSAB1TPSD1TPSG1CYP1A2TDP1
SCHEMBL18505956 0.82 CYP1A2 (0.42) TPSAB1TPSD1TPSG1CYP1A2TDP1
SCHEMBL14852704 0.82 HRH3 (0.56) HRH3

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
WO-2023083194-A1 WEE1 PROTEIN KINASE DEGRADATION AGENT AND USE THEREOF 杭州格博生物医药有限公司 2023-05-19 WO disclosed
WO-2009131246-A1 SORDARIN DERIVATIVES FOR PREVENTING OR TREATING INFECTIOUS DISEASES CAUSED BY PATHOGENIC MICROORGANISMS ASTELLAS PHARMA INC. (JP) 2009-10-29 WO disclosed
WO-2009131246-A1 SORDARIN DERIVATIVES FOR PREVENTING OR TREATING INFECTIOUS DISEASES CAUSED BY PATHOGENIC MICROORGANISMS ASTELLAS PHARMA INC. (JP) 2009-10-29 WO disclosed