SCHEMBL23881997

SCHEMBL23881997

NC(=O)C1(CCc2ccccn2)CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
HRH1 P35367 1/20 0.44
HSD11B1 P28845 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
HPGD P15428 2/20 0.42
RECQL P46063 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL4964661 0.77 LMNA (0.45) GAAHRH1SMN1; SMN2KDM4EALDH1A1
SCHEMBL3392742 0.77 TSHR (0.43) HSD11B1CYP3A4CYP2C19NPC1RAB9A
SCHEMBL20825349 0.75 HRH1 (0.47) GAAHRH1HSD11B1SMN1; SMN2L3MBTL1
SCHEMBL8283151 0.75 GAA (0.50) GAASMN1; SMN2HPGDRECQLKDM4E
SCHEMBL1216003 0.74 L3MBTL1 (0.40) GAAHRH1HSD11B1SMN1; SMN2L3MBTL1
SCHEMBL5815466 0.72 LMNA (0.45) SMN1; SMN2MAPK1ALDH1A1MEN1KMT2A
SCHEMBL11373713 0.71 PARP10 (0.47) SMN1; SMN2HPGDMAPK1KDM4EALDH1A1
SCHEMBL12564742 0.70 GAA (0.46) GAASMN1; SMN2HPGDRECQLL3MBTL1
SCHEMBL18342997 0.70 LMNA (0.46) SMN1; SMN2L3MBTL1MAPK1ALDH1A1MEN1
SCHEMBL626826 0.70 HRH1 (0.57) HRH1SMN1; SMN2HPGDMAPK1ALOX15

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
EP-4125778-A1 OIL-IN-WATER EMULSION COMPRISING A SOLID LIPID MATERIAL Firmenich SA (CH) 2023-02-08 EP disclosed
WO-2021198198-A1 OIL-IN-WATER EMULSION COMPRISING A SOLID LIPID MATERIAL FIRMENICH SA (CH) 2021-10-07 WO disclosed