SCHEMBL18697385

SCHEMBL18697385

O=C(F)OCCOCCOCCOC(=O)F

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.46
ALDH1A1 P00352 3/20 0.46
TP53 P04637 2/20 0.46
HIF1A Q16665 2/20 0.46
HSD17B10 Q99714 2/20 0.46
SERPINE1 P05121 2/20 0.41
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
THRB P10828 1/20 0.34
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
MAPK1 P28482 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
SCHEMBL18697355 1.00 TSHR (0.46) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL4950495 0.90 SERPINE1 (0.35) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL28905611 0.84 SERPINE1 (0.32) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL24925559 0.81 ALDH1A1 (0.38) ALDH1A1SERPINE1
SCHEMBL18686709 0.78 SERPINE1 (0.39) TSHRALDH1A1SERPINE1KMT2A
SCHEMBL18686711 0.78 TSHR (0.42) TSHRALDH1A1SERPINE1
SCHEMBL27616753 0.77
SCHEMBL25400228 0.77 HCAR2 (0.43) TSHRALDH1A1HSD17B10
SCHEMBL26267493 0.77 ALDH1A1 (0.54) TSHRALDH1A1HSD17B10
SCHEMBL18697367 0.75 TSHR (0.46) TSHRALDH1A1

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-20170194664-A1 NONAQUEOUS ELECTROLYTE AND ELECTRICITY STORING DEVICE IN WHICH SAME IS USED MU IONIC SOLUTIONS CORPORATION (JP) 2017-07-06 US disclosed
US-20170194664-A1 NONAQUEOUS ELECTROLYTE AND ELECTRICITY STORING DEVICE IN WHICH SAME IS USED MU IONIC SOLUTIONS CORPORATION (JP) 2017-07-06 US disclosed
EP-3151326-A1 NONAQUEOUS ELECTROLYTE AND ELECTRICITY-STORING DEVICE IN WHICH SAME IS USED Ube Industries, Ltd. (JP) 2017-04-05 EP disclosed