SCHEMBL28348704

SCHEMBL28348704

N#CC1CCN(c2ccccc2-c2ccccc2F)CC1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.65
ALDH1A1 P00352 5/20 0.45
HPGD P15428 3/20 0.41
HSD17B10 Q99714 3/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NOTUM Q6P988 1/20 0.38
EGLN2 Q96KS0 1/20 0.38
HTR7 P34969 6/20 0.38
HTR1A P08908 3/20 0.37
GAA P10253 1/20 0.36
HTR2B P41595 1/20 0.36
HTR3A P46098 1/20 0.36
HTR6 P50406 1/20 0.36

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
SCHEMBL27850036 0.87 KDM4E (0.72) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL20522394 0.82 HTR7 (0.58) KDM4EALDH1A1HPGDEGLN2HTR7
SCHEMBL2072485 0.79 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL30413179 0.76 KDM4E (0.65) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL28348705 0.75 KDM4E (0.53) KDM4EALDH1A1HPGDHSD17B10LMNA
Hydrochloric Acid SCHEMBL30411740 0.74 KDM4E (0.63) KDM4EALDH1A1HPGDHSD17B10LMNA
Hydrochloric Acid SCHEMBL8729997 0.74 KDM4E (0.55) KDM4EALDH1A1LMNANOTUMEGLN2
SCHEMBL3554921 0.74 KDM4E (0.55) KDM4EALDH1A1HPGDLMNATSHR
SCHEMBL30389269 0.71 KDM4E (0.51) KDM4EALDH1A1MAPTEGLN2GAA
SCHEMBL14804201 0.70 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10NOTUM

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-117024352-A Novel inhibitors 维沃里翁治疗股份有限公司 2023-11-10 CN disclosed
CN-110719910-B Novel inhibitors 维沃里翁治疗股份有限公司 2023-07-21 CN disclosed
CN-110719910-A Novel inhibitors 前体生物药物股份公司 2020-01-21 CN disclosed