SCHEMBL26460935

SCHEMBL26460935

CC1(C)CCNCCCNCCNC1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 1/20 0.32
SOS1 Q07889 1/20 0.31
SOS2 Q07890 1/20 0.31
TSHR P16473 1/20 0.31
HIF1A Q16665 1/20 0.30
MAPT P10636 1/20 0.30
PDE4A P27815 1/20 0.30
KDR P35968 1/20 0.30

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
SCHEMBL21305079 0.92 HIF1A (0.35) CXCR4SMN1; SMN2SOS1SOS2TSHR
SCHEMBL14580318 0.87 CXCR4 (0.53) CXCR4SMN1; SMN2ALDH1A1SOS1SOS2
SCHEMBL83077 0.87
Iodide SCHEMBL902785 0.84
Hydrochloric Acid SCHEMBL83844 0.84
SCHEMBL26740945 0.82 TSHR (0.31) TSHR
SCHEMBL26157 0.81
SCHEMBL28016430 0.81 TSHR (0.33) SOS1SOS2TSHR
SCHEMBL21483242 0.81 CXCR4 (0.41) CXCR4SMN1; SMN2ALDH1A1SOS1SOS2
Water SCHEMBL21001070 0.79

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-2023077150-A1 POLYMERS AND NANOPARTICLES FOR INTRAMUSCULAR NUCLEIC ACID DELIVERY THE JOHNS HOPKINS UNIVERSITY (US) 2023-05-04 WO disclosed