SCHEMBL29013142

SCHEMBL29013142

CCCCOC(=O)CC(N)(CCCC)CCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.46
ALDH1A1 P00352 2/20 0.45
ATM Q13315 1/20 0.42
DGKA P23743 1/20 0.41
HTR2C P28335 1/20 0.41
TSHR P16473 3/20 0.40
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 2/20 0.40
RAD52 P43351 1/20 0.40
FAAH O00519 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PDE4D Q08499 1/20 0.38
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37

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
SCHEMBL8601163 0.86 NAAA (0.49) NAAAALDH1A1DGKAHTR2CNPSR1
SCHEMBL27872755 0.81 NAAA (0.48) NAAAALDH1A1ATMDGKAHTR2C
SCHEMBL27560468 0.79 NAAA (0.47) NAAAALDH1A1ATMDGKAHTR2C
SCHEMBL16126196 0.79 DGKA (0.52) NAAAALDH1A1ATMDGKAHTR2C
Ammonia Solution, Strong SCHEMBL3919338 0.79 NAAA (0.47) NAAAALDH1A1ATMDGKAHTR2C
SCHEMBL9471196 0.78 NAAA (0.46) NAAAALDH1A1ATMDGKAHTR2C
SCHEMBL7864345 0.78 NAAA (0.46) NAAAALDH1A1ATMDGKAHTR2C
SCHEMBL5175437 0.77 DGKA (0.46) NAAAALDH1A1ATMDGKAHTR2C
SCHEMBL11788496 0.76 NAAA (0.44) NAAAALDH1A1ATMDGKAHTR2C
SCHEMBL15876200 0.76 ALDH1A1 (0.52) NAAAALDH1A1ATMDGKAHTR2C

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
CN-116075537-A Solvent for resin synthesis and method for producing synthetic resin using the same 科巨希化学股份有限公司 2023-05-05 CN disclosed