SCHEMBL28159643

SCHEMBL28159643

CSc1ccc(C2(C)CNCCO2)cc1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
NISCH Q9Y2I1 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
SCHEMBL1332923 0.81 SLC6A2 (0.41) SLC6A4SLC6A3
SCHEMBL14932316 0.80 SLC6A2 (0.42) SLC6A4SLC6A3
SCHEMBL9086991 0.80 TAAR1 (0.35) SLC6A4SLC6A3
SCHEMBL2249850 0.80 SLC6A2 (0.42) SLC6A4SLC6A3
SCHEMBL323576 0.80 MMP2 (0.36) SLC6A4SLC6A3
SCHEMBL1334863 0.80 HTR2A (0.44) SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL28135009 0.79 SLC6A2 (0.41) SLC6A4SLC6A3
Bromide SCHEMBL5224748 0.78 HTR2A (0.43) SLC6A4SLC6A3
SCHEMBL28041917 0.76 SLC6A2 (0.32) SLC6A4SLC6A3
SCHEMBL20082659 0.73 ALDH1A1 (0.33)

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
CN-109843986-A Spherical powder comprising crosslinked material having polyrotaxane, and method for producing same 高级软质材料株式会社 2019-06-04 CN disclosed
CN-109071742-A Resin combination, its cured film and its manufacturing method and solid photographic device 东丽株式会社 2018-12-21 CN disclosed
CN-108976452-A The active energy ray-curable composition of formation curing overlay film and gained hard coat film and laminated body on annular ethylene series resin substrate 日本化工涂料株式会社 2018-12-11 CN disclosed
CN-103319923-B Actinic-radiation curable composition and application film 关西涂料株式会社 2017-10-03 CN disclosed
CN-104583332-B Improved silica composition 株式会社ADEKA 2017-06-23 CN disclosed