SCHEMBL8513461

SCHEMBL8513461

CCCCC=C(CCCC)C(=O)OCN

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.41
FAAH O00519 4/20 0.35
ALDH1A1 P00352 2/20 0.35
CNR1 P21554 2/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
CES1 P23141 2/20 0.34
CES2 O00748 1/20 0.34
EP300 Q09472 1/20 0.34
TP53 P04637 2/20 0.33
CYP1A2 P05177 2/20 0.33
F7 P08709 1/20 0.33
F3 P13726 1/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
SOAT1 P35610 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR2C P28335 1/20 0.33
ATM Q13315 1/20 0.32

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
SCHEMBL8514343 0.90 FAAH (0.46) FAAHMAPTEP300TP53CYP1A2
SCHEMBL5052694 0.87 ALDH1A1 (0.46) GRIK1FAAHALDH1A1CNR1MAPT
SCHEMBL28899301 0.85 GRIK1 (0.39) GRIK1FAAHALDH1A1CNR1MAPT
SCHEMBL2867199 0.84 ATM (0.46) GRIK1FAAHALDH1A1MAPTCES1
SCHEMBL6312933 0.84 ATM (0.46) GRIK1FAAHALDH1A1MAPTCES1
SCHEMBL28354229 0.83 ATM (0.44) GRIK1FAAHALDH1A1MAPTCES1
SCHEMBL27976273 0.83 ATM (0.44) GRIK1FAAHALDH1A1MAPTCES1
SCHEMBL28107299 0.80 GRIK1 (0.41) GRIK1FAAHALDH1A1CNR1CES1
Phosphoric Acid SCHEMBL29128916 0.80 FAAH (0.43) GRIK1FAAHALDH1A1MAPTCES1
SCHEMBL9601168 0.79 FAAH (0.57) FAAHMAPTEP300TP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8789937-B2 Ink jet recording method and liquid dispersant RICOH COMPANY, LTD. (JP) 2014-07-29 US disclosed
US-8752947-B2 Ink jet recording method and liquid dispersant RICOH COMPANY, LTD. (JP) 2014-06-17 US disclosed
US-20120133702-A1 INK JET RECORDING METHOD AND LIQUID DISPERSANT RICOH COMPANY, LTD. (JP) 2012-05-31 US disclosed
US-20120133703-A1 INK JET RECORDING METHOD AND LIQUID DISPERSANT RICOH COMPANY, LTD. (JP) 2012-05-31 US disclosed
US-4659781-A Reactive acrylic oligomer, grafted acrylic resinous composition based on said oligomer and coating composition containing the same NIPPON PAINT CO., LTD. (JP) 1987-04-21 US disclosed