SCHEMBL23735548

SCHEMBL23735548

CCNCCCN1CCN=C1C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 1/20 0.40
CYP2C19 P33261 2/20 0.35
MEN1 O00255 1/20 0.35
GLA P06280 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
SAT1 P21673 1/20 0.31
KDM1A O60341 1/20 0.31

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
SCHEMBL17187510 0.80 KDM4E (0.50) KDM4EALDH1A1
SCHEMBL25009530 0.80 KDM4E (0.40) KDM4EALDH1A1MEN1KMT2ACYP1A2
SCHEMBL18198890 0.77 KDM4E (0.45) KDM4EALDH1A1CYP1A2
SCHEMBL11140291 0.77 MEN1 (0.41) KDM4EALDH1A1MEN1KMT2A
SCHEMBL14682806 0.76 ACE2 (0.46) KDM4EALDH1A1CYP2C19MEN1KMT2A
SCHEMBL14255598 0.75
SCHEMBL8143727 0.74 KDM4E (0.49) KDM4EALDH1A1CYP1A2
SCHEMBL11839292 0.74 KDM4E (0.39) KDM4EALDH1A1CYP1A2TSHR
SCHEMBL11137223 0.72 MAOA (0.53)
SCHEMBL515382 0.71

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
EP-3154688-B1 CROSS-LINKING CATALYST COMPRISING SILOXANE STRUCTURAL UNITS SIKA TECH AG (CH) 2021-08-11 EP disclosed