SCHEMBL10691070

SCHEMBL10691070

C=CC(OC1CCCCO1)c1ccccc1OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SGMS2 Q8NHU3 8/20 0.36
LMNA P02545 2/20 0.36
CCR5 P51681 1/20 0.35
HTR1A P08908 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
MAPT P10636 2/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33

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
SCHEMBL9330242 0.77 KDM4C (0.32) KDM4C
SCHEMBL8601015 0.76 MEN1 (0.44) ALDH1A1MEN1KMT2ASGMS2CCR5
SCHEMBL10691066 0.74 DHFR (0.39) ALDH1A1MEN1KMT2ASGMS2CCR5
SCHEMBL6200378 0.74 GAA (0.42) ALDH1A1MEN1KMT2ASGMS2LMNA
SCHEMBL7108953 0.73 POLB (0.34) MEN1KMT2ACCR5SLC6A3HPGD
SCHEMBL772662 0.72 KDM4C (0.47) ALDH1A1MEN1KMT2ASGMS2CCR5
SCHEMBL9332566 0.72 HTR1A (0.31) HTR1AL3MBTL1
SCHEMBL8350940 0.72 MEN1 (0.50) ALDH1A1MEN1KMT2ASGMS2CCR5
SCHEMBL8601204 0.72 CCR5 (0.45) ALDH1A1MEN1KMT2ASGMS2CCR5
SCHEMBL27252708 0.70 MAPT (0.44) ALDH1A1MEN1KMT2ASGMS2CCR5

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-4761420-A CARDIOVASCULAR DISORDERS LABORATOIRES SYNTEX S.A. (FR) 1988-08-02 US disclosed