SCHEMBL6530561

SCHEMBL6530561

[c]1ccc(OC2CCCC(COC3CC[CH]CCC3)CC2)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
PARP10 Q53GL7 1/20 0.32
SLC6A2 P23975 3/20 0.31
SLC6A4 P31645 3/20 0.31
SLC6A3 Q01959 3/20 0.31
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSK P43235 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
SCHEMBL6531732 0.85 JAK2 (0.30) JAK2JAK1
SCHEMBL6531749 0.85 HRH3 (0.30)
SCHEMBL4353074 0.83 PARP10 (0.39) PARP10SLC6A2SLC6A4SLC6A3
SCHEMBL6530841 0.80 JAK2 (0.32) JAK2JAK1
SCHEMBL231982 0.75 PARP10 (0.48) PARP10SLC6A2SLC6A4SLC6A3
SCHEMBL6530753 0.75 JAK2 (0.36) JAK2JAK1CTSLCTSBCTSK
SCHEMBL6531228 0.72
SCHEMBL21281 0.72 PARP10 (0.44) PARP10
SCHEMBL28832433 0.72 JAK2 (0.47) JAK2JAK1CTSLCTSBCTSK
SCHEMBL333383 0.72 HRH1 (0.43) PARP10SLC6A2SLC6A4SLC6A3

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
US-8487071-B2 Polyether polymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-16 US disclosed
US-20110065889-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-17 US disclosed