SCHEMBL9509874

SCHEMBL9509874

CCCCC(=O)OC(C)CCC(C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
ACE2 Q9BYF1 1/20 0.49
FAAH O00519 4/20 0.47
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
CYP1A2 P05177 2/20 0.44
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
EPHX2 P34913 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LTA4H P09960 1/20 0.40
GABRR1 P24046 2/20 0.39
BLM P54132 1/20 0.39

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
SCHEMBL9509850 0.95 LMNA (0.58) LMNAACE2FAAHCNR1CNR2
SCHEMBL9507450 0.93 LMNA (0.61) LMNAACE2FAAHCNR1CNR2
SCHEMBL9509877 0.93 LMNA (0.61) LMNAACE2FAAHCNR1CNR2
SCHEMBL9703061 0.93 LMNA (0.61) LMNAACE2FAAHCNR1CNR2
SCHEMBL9511204 0.89 CYP1A2 (0.47) LMNAACE2FAAHCNR1CNR2
SCHEMBL11386694 0.85 LMNA (0.57) LMNAFAAHCNR1CNR2MAPT
SCHEMBL880135 0.85 LMNA (0.57) LMNAFAAHCNR1CNR2CYP1A2
SCHEMBL9508692 0.84 LMNA (0.52) LMNAFAAHCNR1CNR2MAPT
SCHEMBL27465616 0.83 LMNA (0.71) LMNAFAAHCNR1CNR2CYP1A2
SCHEMBL22534407 0.83 FAAH (0.60) LMNAFAAHCNR1CNR2MAPT

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-0388960-B1 OPTICALLY ACTIVE COMPOUNDS AND THEIR PREPARATION AND USE HITACHI, LTD. (JP) 1993-10-06 EP disclosed
US-5152919-A Stability, chemical resistance, high speed response, large spo ntaneous polarization, molecular orientation and wide temperat ure range HITACHI, LTD. (JP) 1992-10-06 US disclosed
EP-0388960-A1 Optically active compounds and their preparation and use HITACHI, LTD. (JP) 1990-09-26 EP disclosed