SCHEMBL8045903

SCHEMBL8045903

CC(C)CN(CC(C)C)C1CCC(OC2CCC([O])CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.33
SLC6A4 P31645 10/20 0.33
SLC6A3 Q01959 4/20 0.31
PIK3CD O00329 2/20 0.31

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
SCHEMBL8045906 0.82 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3PIK3CD
SCHEMBL23733657 0.78 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3PIK3CD
SCHEMBL26767657 0.71 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3PIK3CD
SCHEMBL20321696 0.69 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3PIK3CD
SCHEMBL20321803 0.69 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3PIK3CD
SCHEMBL824136 0.68 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3PIK3CD
SCHEMBL2481382 0.68 ADH1C (0.40) SLC6A2SLC6A4SLC6A3PIK3CD
SCHEMBL29952650 0.67 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3PIK3CD
SCHEMBL21047919 0.66 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3PIK3CD
SCHEMBL9289972 0.65 HTR1D (0.43) SLC6A2SLC6A4SLC6A3PIK3CD

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-6106999-A SENSITIVITY TO GENERAL-PURPOSE VISIBLE LIGHT LASER, SO THAT HIGH-SPEED SCANNING EXPOSURE IS POSSIBLE BY LASER, AND EXTREMELY FINE HIGH RESOLUTION CAN BE OBTAINED; CAN BE USED FOR COATING OR PRINTING UNDER SAFELIGHT IRRADIATING CONDITIONS MITSUI CHEMICALS (JP) 2000-08-22 US disclosed