SCHEMBL11578564

SCHEMBL11578564

CN(C)CCCCOc1cccc(OCCCCN(C)C)n1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.62
HTR1B P28222 2/20 0.56
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 3/20 0.50
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
LSS P48449 1/20 0.47
TOP2A P11388 1/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL7529925 0.94 HTR7 (0.64) HTR7HTR1BALDH1A1KDM4ELSS
SCHEMBL7535239 0.88 HTR7 (0.77) HTR7HTR1BALDH1A1KDM4ELMNA
SCHEMBL14084399 0.85 HTR7 (0.55) HTR7HTR1BALDH1A1KDM4EMAPT
SCHEMBL14108022 0.84 HTR7 (0.57) HTR7HTR1BALDH1A1KDM4ELSS
SCHEMBL4901032 0.82 HTR7 (0.55) HTR7HTR1BALDH1A1KDM4ELSS
SCHEMBL15721462 0.82 HTR7 (0.51) HTR7HTR1BALDH1A1KDM4ELSS
SCHEMBL8403606 0.81 HTR7 (0.68) HTR7HTR1BALDH1A1KDM4ESMN1; SMN2
SCHEMBL28214028 0.81 HTR1B (0.49) HTR7HTR1BALDH1A1KDM4ELSS
SCHEMBL16093361 0.81 HTR7 (0.54) HTR7HTR1BALDH1A1KDM4ELSS
SCHEMBL14084396 0.80 HTR7 (0.56) HTR7HTR1BALDH1A1KDM4ELSS

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
US-4090988-A Polyurethane foam preparation using pyridine ether catalysts OLIN CORPORATION (US) 1978-05-23 US disclosed