SCHEMBL10474231

SCHEMBL10474231

CCCCCCCCC1CN(CCCCCO)CCO1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.47
ALDH1A1 P00352 1/20 0.42
GBA1 P04062 1/20 0.41
GUSB P08236 2/20 0.41
EBP Q15125 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
BCHE P06276 2/20 0.39
HTR1A P08908 5/20 0.38
DRD2 P14416 5/20 0.38
DRD1 P21728 5/20 0.38
DRD4 P21917 5/20 0.38
DRD5 P21918 5/20 0.38
DRD3 P35462 5/20 0.38

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
SCHEMBL2357033 0.90 EPHX1 (0.47) EPHX1ALDH1A1GBA1EBPSIGMAR1
Hydrochloric Acid SCHEMBL27889721 0.88 EPHX1 (0.46) EPHX1ALDH1A1GBA1SIGMAR1DRD2
SCHEMBL8283682 0.85 SIGMAR1 (0.42) EPHX1GBA1SIGMAR1HTR1ADRD2
SCHEMBL2357921 0.85 EPHX1 (0.52) EPHX1ALDH1A1EBPSIGMAR1DRD4
Tetrahydrofuran SCHEMBL27678687 0.83 EPHX1 (0.41) EPHX1ALDH1A1BCHEDRD3
SCHEMBL7324183 0.83 GBA1 (0.43) GBA1GUSBEBPSIGMAR1BCHE
SCHEMBL9936176 0.83 EPHX1 (0.44) EPHX1ALDH1A1GBA1EBPSIGMAR1
SCHEMBL27419278 0.82 EPHX1 (0.44) EPHX1ALDH1A1GUSBEBPSIGMAR1
SCHEMBL5659819 0.82 EBP (0.47) EPHX1GUSBEBPSIGMAR1BCHE
SCHEMBL10682538 0.82 EPHX1 (0.56) EPHX1ALDH1A1EBPSIGMAR1DRD4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4894221-A Method of treating plaque using morpholine compounds AB FERROSAN (SE) 1990-01-16 US disclosed
US-4636382-A ANTIPLAQUE AB FERROSAN (SE) 1987-01-13 US disclosed
EP-0038785-B1 NOVEL MORPHOLINO COUMPOUNDS AB Ferrosan (SE) 1985-11-13 EP disclosed
EP-0038785-A1 Novel morpholino coumpounds AB Ferrosan (SE) 1981-10-28 EP disclosed