Sugi Predict

Sugi Predict / Compounds / SCHEMBL13617040

SCHEMBL13617040

SCHEMBL13617040

CCC(C(=O)OCC(O)CC1CCCCC1C(=O)OC)(C(C)C)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 1/20 0.36
▸ ADRB1 P08588 1/20 0.36
▸ ADRB3 P13945 1/20 0.36
▸ HMGCR P04035 1/20 0.32
▸ SLC6A2 P23975 1/20 0.30
▸ FKBP1A P62942 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
SCHEMBL13607525 0.86 ADRB2 (0.41) ADRB2ADRB1ADRB3SLC6A2FKBP1A
SCHEMBL13617032 0.85 ADRB2 (0.40) ADRB2ADRB1ADRB3SLC6A2FKBP1A
SCHEMBL13617033 0.83 HMGCR (0.38) ADRB2ADRB1ADRB3HMGCR
SCHEMBL13617039 0.81 HMGCR (0.36) ADRB2ADRB1ADRB3HMGCR
SCHEMBL13617035 0.78 ADRB2 (0.33) ADRB2ADRB1ADRB3SLC6A2FKBP1A
SCHEMBL13617037 0.78 ADRB2 (0.33) ADRB2ADRB1ADRB3SLC6A2FKBP1A
SCHEMBL13617196 0.78 ADRB2 (0.39) ADRB2ADRB1ADRB3HMGCR
SCHEMBL13616554 0.77 ADRB2 (0.39) ADRB2ADRB1ADRB3HMGCR
SCHEMBL13617034 0.76 ADRB2 (0.38) ADRB2ADRB1ADRB3
SCHEMBL14548638 0.74 TP53 (0.32) ADRB2ADRB1ADRB3

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-8350144-B2 Hybrid photovoltaic cell module RAMESH SWAMINATHAN (US) 2013-01-08 — — US disclosed
US-20090288706-A1 Hybrid Photovoltaic Cell Module RAMESH SWAMINATHAN 2009-11-26 — — US disclosed