SCHEMBL23777963

SCHEMBL23777963

CCCC(C)CC(N)C(O)=S

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
SLC1A2 P43004 4/20 0.39
SLC1A1 P43005 4/20 0.39
GRIK1 P39086 4/20 0.39
GRIK2 Q13002 4/20 0.39
SLC1A3 P43003 3/20 0.39
METAP1 P53582 1/20 0.32
SLC7A5 Q01650 1/20 0.32
OPRM1 P35372 1/20 0.30
CHRM1 P11229 1/20 0.30
AKR1A1 P14550 1/20 0.30
CHRM3 P20309 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 1/20 0.30
SLC6A3 Q01959 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30

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
SCHEMBL23777975 0.88 SLC1A2 (0.43) SLC1A2SLC1A1GRIK1GRIK2SLC1A3
SCHEMBL23777967 0.82 SLC1A3 (0.35) SLC1A2SLC1A1SLC1A3SLC7A5
SCHEMBL30707879 0.79
SCHEMBL1146614 0.79
SCHEMBL3101060 0.79
SCHEMBL18229136 0.78 SLC1A2 (0.64) SLC1A2SLC1A1GRIK1GRIK2SLC1A3
SCHEMBL3383446 0.78 SLC1A2 (0.64) SLC1A2SLC1A1GRIK1GRIK2SLC1A3
SCHEMBL18229129 0.78 SLC1A2 (0.64) SLC1A2SLC1A1GRIK1GRIK2SLC1A3
SCHEMBL839403 0.78 SLC1A2 (0.64) SLC1A2SLC1A1GRIK1GRIK2SLC1A3
Hydrochloric Acid SCHEMBL5612600 0.77 SLC1A2 (0.62) SLC1A2SLC1A1GRIK1GRIK2SLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3875590-A1 METHOD FOR PRODUCING ORGANIC COMPOUND AND CORYNEFORM BACTERIUM Green Earth Institute Co., Ltd. (JP) 2021-09-08 EP disclosed
CN-111315888-A Method for producing organic compound and coryneform bacterium 绿色地球研究所株式会社 2020-06-19 CN disclosed