SCHEMBL28348705

SCHEMBL28348705

N#CC1CCN(c2c(F)cccc2-c2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 3/20 0.52
EGLN2 Q96KS0 1/20 0.39
SSTR2 P30874 6/20 0.38
USP30 Q70CQ3 1/20 0.37
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
EED O75530 1/20 0.36
FEN1 P39748 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
DPP4 P27487 1/20 0.34
LTA4H P09960 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
NOTUM Q6P988 1/20 0.33
IDO1 P14902 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
SCHEMBL30413179 0.85 KDM4E (0.65) KDM4EALDH1A1EGLN2LMNAMAPT
Hydrochloric Acid SCHEMBL30411740 0.84 KDM4E (0.63) KDM4EALDH1A1EGLN2LMNAMAPT
SCHEMBL14804201 0.78 KDM4E (0.57) KDM4EALDH1A1EGLN2HPGDHSD17B10
SCHEMBL28348704 0.75 KDM4E (0.65) KDM4EALDH1A1EGLN2LMNAMAPT
SCHEMBL1938769 0.75 KDM4E (0.46) KDM4EALDH1A1EGLN2SSTR2EGLN1
SCHEMBL20522394 0.73 HTR7 (0.58) KDM4EALDH1A1EGLN2HPGDFEN1
SCHEMBL3442725 0.70 KDM4E (0.56) KDM4EALDH1A1EGLN2USP30LMNA
SCHEMBL2072485 0.70 KDM4E (1.00) KDM4EALDH1A1EGLN2LMNAHPGD
SCHEMBL1939787 0.68 ATR (0.44) KDM4EALDH1A1SSTR2EGLN1NOTUM
SCHEMBL1939792 0.68 ATR (0.44) KDM4EALDH1A1SSTR2EGLN1NOTUM

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