SCHEMBL7863401

SCHEMBL7863401

C=CC(=O)OC1(C)OCCO1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
TSHR P16473 6/20 0.32
HPGD P15428 1/20 0.31
TP53 P04637 2/20 0.30
HIF1A Q16665 2/20 0.30
CYP3A4 P08684 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL31578484 0.78 TSHR (0.32) ALDH1A1TSHRTP53HIF1ACYP3A4
SCHEMBL30679778 0.78 ALDH1A1 (0.33) ALDH1A1TSHRHPGD
SCHEMBL21373895 0.77
SCHEMBL12796084 0.76
SCHEMBL6034781 0.75 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL29279607 0.74 LMNA (0.31)
Acrylic Acid Methyl Ester SCHEMBL28105778 0.73 HCAR2 (0.36) ALDH1A1TSHRHPGD
SCHEMBL12796112 0.73
SCHEMBL4365632 0.73 TSHR (0.32) ALDH1A1TSHR
SCHEMBL27552918 0.72 TSHR (0.32) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6315918-B1 CAPACITOR HAVING HIGH ENERGY DENSITY AND EXCELLENT WITH-STAND VOLTAGE AND CHARGING/DISCHARGING CYCLE PROPERTIES, AND SAFETY PERFORMANCE MITSUI CHEMICALS INC. (JP) 2001-11-13 US disclosed