SCHEMBL7752435

SCHEMBL7752435

CCCCC(N)(CCCC)C(C)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.41
SPHK1 Q9NYA1 2/20 0.37
SMPD1 P17405 4/20 0.34
OPRM1 P35372 1/20 0.33
KIF11 P52732 1/20 0.33
TP53 P04637 2/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.30
CYP2D6 P10635 2/20 0.30
GMNN O75496 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
THPO P40225 1/20 0.30
MTOR P42345 1/20 0.30
BLM P54132 1/20 0.30
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
CETP P11597 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
SCHEMBL6558334 0.91 FDPS (0.45) FDPSSPHK1SMPD1
Hydrochloric Acid SCHEMBL6832625 0.89 FDPS (0.44) FDPSSPHK1SMPD1
SCHEMBL18676132 0.82 FDPS (0.43) FDPSSPHK1SMPD1TP53ALDH1A1
Decanoic Acid SCHEMBL7748364 0.82 GPR84 (0.57) ALDH1A1TSHRGMNNLMNAPOLB
SCHEMBL29141406 0.80 FDPS (0.41) FDPSSPHK1SMPD1OPRM1KIF11
SCHEMBL8998092 0.78 FDPS (0.40) FDPSSPHK1SMPD1TSHR
SCHEMBL7313000 0.78 FDPS (0.40) FDPSSPHK1SMPD1OPRM1TP53
SCHEMBL27924094 0.78 FDPS (0.40) FDPSSPHK1SMPD1OPRM1TP53
SCHEMBL9508445 0.77 OPRM1 (0.40) FDPSSPHK1SMPD1OPRM1TP53
SCHEMBL28858347 0.76 FDPS (0.39) FDPSSPHK1SMPD1TP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0732706-B1 Method of improving the electrical conductivity of a shaped resin article and an electrostatic coating process DAI ICHI KOGYO SEIYAKU CO LTD (JP) 2001-01-17 EP disclosed
US-5599591-A USING A CARBOXYLATED AMINE DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1997-02-04 US disclosed
EP-0732706-A2 Method of improving the electrical conductivity of a shaped resin article and an electrostatic coating process DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1996-09-18 EP disclosed