SCHEMBL20833338

SCHEMBL20833338

CC(C)(O)[C@@H]1CCCCN1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C19 P33261 1/20 0.40
RAB9A P51151 1/20 0.40
FDPS P14324 1/20 0.36
CCR2 P41597 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
SCHEMBL16448784 1.00 KDM4E (0.40) KDM4ENPC1CYP1A2CYP2D6HPGD
SCHEMBL1266740 0.93
SCHEMBL1304445 0.93
SCHEMBL2644164 0.93
Hydrochloric Acid SCHEMBL1266559 0.91 KDM4E (0.48) KDM4ENPC1CYP1A2CYP2D6HPGD
Hydrochloric Acid SCHEMBL15192970 0.91 KDM4E (0.48) KDM4ENPC1CYP1A2CYP2D6HPGD
Hydrochloric Acid SCHEMBL15192972 0.91 KDM4E (0.48) KDM4ENPC1CYP1A2CYP2D6HPGD
SCHEMBL6299911 0.85
SCHEMBL22102118 0.85
SCHEMBL6299912 0.85

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-2019055951-A1 TECHNOLOGIES FOR OLIGONUCLEOTIDE PREPARATION WAVE LIFE SCIENCES LTD. (SG) 2019-03-21 WO disclosed