SCHEMBL18263232

SCHEMBL18263232

C=CC(OC)C1(O)CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.31
SLC6A4 P31645 4/20 0.31
SLC6A3 Q01959 4/20 0.31
LMNA P02545 1/20 0.31
CNR1 P21554 1/20 0.31
HTR2A P28223 1/20 0.31
HRH1 P35367 1/20 0.31
HRH3 Q9Y5N1 1/20 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
SCHEMBL4173304 0.70 SLC6A2 (0.31) SLC6A2SLC6A4SLC6A3
SCHEMBL19064358 0.69 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL9136229 0.64 SLC6A2 (0.32) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL11911637 0.62 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL27747732 0.61 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL1414825 0.61 OPRM1 (0.36) SLC6A2SLC6A4SLC6A3
Cyclohexane SCHEMBL11049335 0.61
SCHEMBL18268918 0.61 OPRM1 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL17487284 0.61 OPRM1 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL7943781 0.61

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
EP-3303276-B1 PRODUCTION OF 3-ALKYLPHENOLS UNIV LEUVEN KATH (BE) 2023-04-12 EP disclosed
EP-3303276-A1 PRODUCTION OF 3-ALKYLPHENOLS AND USES THEREOF Katholieke Universiteit Leuven (BE) 2018-04-11 EP disclosed
WO-2016187678-A1 PRODUCTION OF 3-ALKYLPHENOLS AND USES THEREOF KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2016-12-01 WO disclosed