SCHEMBL27265652

SCHEMBL27265652

OB(O)c1ccc(CNCCN2CCCC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.64
KMT2A Q03164 1/20 0.53
SIGMAR1 Q99720 3/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
APP P05067 1/20 0.42
PARP1 P09874 1/20 0.42
CHEK1 O14757 1/20 0.41
MCHR1 Q99705 1/20 0.41
CXCR4 P61073 6/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL3165932 0.87 DPP7 (0.82) DPP7KMT2ASIGMAR1CYP3A4CYP2D6
SCHEMBL3171554 0.85 DPP7 (0.79) DPP7KMT2ASIGMAR1CYP3A4CYP2D6
SCHEMBL3176696 0.80 DPP7 (0.72) DPP7KMT2ASIGMAR1CYP3A4CYP2D6
SCHEMBL14385453 0.79 DPP7 (0.70) DPP7KMT2ASIGMAR1CYP3A4CYP2D6
SCHEMBL18769662 0.79 DPP7 (0.70) DPP7KMT2ASIGMAR1CYP3A4CYP2D6
SCHEMBL3175086 0.79 DPP7 (0.70) DPP7KMT2ASIGMAR1CYP3A4CYP2D6
SCHEMBL3577555 0.79 DPP7 (0.70) DPP7KMT2ASIGMAR1CYP3A4CYP2D6
SCHEMBL2554982 0.78 HRH3 (0.61) SIGMAR1CYP3A4
SCHEMBL5756091 0.78 DPP7 (1.00) DPP7KMT2ASIGMAR1CYP3A4CYP2D6
SCHEMBL23686821 0.78 DPP7 (0.68) DPP7KMT2ASIGMAR1CYP3A4CYP2D6

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
WO-2024026026-A1 HIGH THROUGHPUT IN VIVO SCREENING OF LIPID NANOPARTICLES TRUSTEES OF TUFTS COLLEGE (US) 2024-02-01 WO disclosed