SCHEMBL25944727

SCHEMBL25944727

CCC(CC(C)CC(C)C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 4/20 0.54
SLC1A2 P43004 4/20 0.54
SLC1A1 P43005 3/20 0.54
CA2 P00918 1/20 0.45
MAPK1 P28482 1/20 0.45
CPA1 P15085 1/20 0.44
RNPEP Q9H4A4 1/20 0.43
SLC7A5 Q01650 1/20 0.43
CHRM1 P11229 1/20 0.41
AKR1A1 P14550 1/20 0.41
CHRM3 P20309 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
ADRA1A P35348 1/20 0.41
HRH1 P35367 1/20 0.41
DRD3 P35462 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL12191525 0.88 SLC1A3 (0.60) SLC1A3SLC1A2SLC1A1CA2MAPK1
SCHEMBL807054 0.88 SLC1A3 (0.60) SLC1A3SLC1A2SLC1A1CA2MAPK1
SCHEMBL322526 0.88 SLC1A3 (0.60) SLC1A3SLC1A2SLC1A1CA2MAPK1
SCHEMBL15677325 0.86 SLC1A3 (0.61) SLC1A3SLC1A2SLC1A1CA2MAPK1
SCHEMBL8314295 0.86 SLC1A3 (0.58) SLC1A3SLC1A2SLC1A1CA2MAPK1
SCHEMBL11809258 0.86 SLC1A3 (0.58) SLC1A3SLC1A2SLC1A1CA2MAPK1
SCHEMBL1716335 0.86 SLC1A3 (0.58) SLC1A3SLC1A2SLC1A1CA2MAPK1
SCHEMBL17618960 0.84 SLC1A3 (0.52) SLC1A3SLC1A2SLC1A1CA2MAPK1
SCHEMBL751062 0.83 SLC1A2 (0.71) SLC1A3SLC1A2SLC1A1CA2MAPK1
SCHEMBL2233673 0.82 SLC1A1 (0.54) SLC1A3SLC1A2SLC1A1CA2MAPK1

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
US-20230231139-A1 BINDER, NEGATIVE-ELECTRODE SLURRY, NEGATIVE ELECTRODE, AND LITHIUM-ION BATTERY ENVISION DYNAMICS TECHNOLOGY (JIANGSU) CO., LTD. (CN) 2023-07-20 US disclosed