SCHEMBL9136229

SCHEMBL9136229

COC(C(C)O)C1(O)CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.32
SLC6A4 P31645 4/20 0.32
SLC6A3 Q01959 4/20 0.32
LMNA P02545 1/20 0.32
CNR1 P21554 1/20 0.32
HTR2A P28223 1/20 0.32
HRH1 P35367 1/20 0.32
HRH3 Q9Y5N1 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
SCHEMBL29121614 0.78 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL19064358 0.75 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL7864095 0.71 KDM4E (0.40) SLC6A2SLC6A4SLC6A3LMNA
SCHEMBL7934841 0.71 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL9380578 0.71 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL3764843 0.71 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL6092506 0.68
SCHEMBL1414825 0.68 OPRM1 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL18268918 0.68 OPRM1 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL17487284 0.68 OPRM1 (0.36) SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5414144-A Detergent, solvent, film-forming agent ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1995-05-09 US claimed
CN-107614557-A Manufacture method, water-dispersed composition, liquid composite, resin combination and the resin cured matter of poly- carbodiimide composition, poly- carbodiimide composition 三井化学株式会社 2018-01-19 CN disclosed
US-5414144-A Detergent, solvent, film-forming agent ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1995-05-09 US disclosed