SCHEMBL7516664

SCHEMBL7516664

CCCC(COCC1CO1)CC(COCC1CO1)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 2/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL7521567 0.88 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL7518395 0.87 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL7520982 0.84 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL9010893 0.84 ALDH1A1 (0.69) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL7526417 0.83 ALDH1A1 (0.69) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL28560049 0.80 ALDH1A1 (0.81) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL7516655 0.79 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL7529243 0.79 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL23152457 0.78 ALDH1A1 (0.81) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL172426 0.76 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1

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-0911326-B1 DIGLYCIDYL ETHERS KYOWA YUKA KK (JP) 2002-01-30 EP disclosed
US-6048956-A DIGLYCIDYL ETHERS OF DIOLS KYOWA YUKA CO., LTD. (JP) 2000-04-11 US disclosed
EP-0911326-A1 DIGLYCIDYL ETHERS Kyowa Yuka Co., Ltd. (JP) 1999-04-28 EP disclosed