SCHEMBL5233789

SCHEMBL5233789

COCCCOC[C@H]1CCCN(C(=O)O)C1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
REN P00797 4/20 0.38
GAA P10253 1/20 0.38
SPHK1 Q9NYA1 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP4F2 P78329 2/20 0.35
CYP4A11 Q02928 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
GRM3 Q14832 2/20 0.34

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
SCHEMBL8574641 0.88 PDK1 (0.43) POLBKMT2AALDH1A1CYP4F2CYP4A11
SCHEMBL3655590 0.84 POLB (0.44) POLBKMT2AALDH1A1NPC1RAB9A
SCHEMBL3778464 0.84 POLB (0.44) POLBKMT2AALDH1A1NPC1RAB9A
SCHEMBL3780673 0.83 GAA (0.40) POLBGAAKMT2AALDH1A1NPC1
SCHEMBL3780679 0.83 GAA (0.40) POLBGAAKMT2AALDH1A1NPC1
SCHEMBL4434030 0.83 ALDH1A1 (0.43) POLBKMT2AALDH1A1NPC1RAB9A
SCHEMBL22366358 0.82 PDK1 (0.37) POLBSPHK1KMT2AALDH1A1NPC1
SCHEMBL22319904 0.82 PDK1 (0.37) POLBSPHK1KMT2AALDH1A1NPC1
SCHEMBL6134733 0.80 ALDH1A1 (0.38) SPHK1KMT2AALDH1A1RAB9A
SCHEMBL7288809 0.80 PTGIR (0.37) ALDH1A1CYP4F2CYP4A11GRM3

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
EP-1764367-A1 THIENOPYRIDINE DERIVATIVES Sankyo Company, Limited (JP) 2007-03-21 EP disclosed