SCHEMBL31035868

SCHEMBL31035868

CCCON1CCCC(C)C1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 2/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
HRH3 Q9Y5N1 11/20 0.36
MAOB P27338 2/20 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
SCHEMBL31550868 0.88 KDM4E (0.36) KDM4EALDH1A1LMNAMEN1POLB
SCHEMBL32681711 0.84 KDM4E (0.40) KDM4EALDH1A1LMNAMEN1POLB
SCHEMBL31035961 0.75 HPGD (0.35) KDM4EALDH1A1MAPTHRH3MAOB
SCHEMBL8703416 0.74
SCHEMBL2269684 0.74
SCHEMBL727903 0.74
SCHEMBL771653 0.73
SCHEMBL3104689 0.72 TSHR (0.32) ALDH1A1MEN1KMT2A
SCHEMBL170825 0.69 DRD2 (0.51) KDM4EALDH1A1LMNAHRH3
SCHEMBL17888496 0.69 DRD2 (0.51) KDM4EALDH1A1LMNAHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118459447-A Scutellarin aglycone-7-amino carbamate-4' -substituted aminopropyl ether derivative and preparation and application thereof 贵州医科大学 2024-08-09 CN claimed
CN-118459447-A Scutellarin aglycone-7-amino carbamate-4' -substituted aminopropyl ether derivative and preparation and application thereof 贵州医科大学 2024-08-09 CN disclosed