SCHEMBL28058320

SCHEMBL28058320

CCCOC(OCCC)C1CCCO1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL28058219 0.89 SMN1; SMN2 (0.39) ALDH1A1KMT2ARAB9ASMN1; SMN2HSD17B10
SCHEMBL14764021 0.84 ALDH1A1 (0.36) ALDH1A1KMT2AHPGDSMN1; SMN2
SCHEMBL29184202 0.80 ALDH1A1 (0.34) ALDH1A1KMT2ANPC1HPGDRAB9A
SCHEMBL29184201 0.80 HPGD (0.33) ALDH1A1KMT2ANPC1HPGDRAB9A
SCHEMBL4920076 0.78
SCHEMBL14309115 0.75 SLC6A3 (0.32)
SCHEMBL10306297 0.73 SMN1; SMN2 (0.38) ALDH1A1KMT2AHPGDRAB9ASMN1; SMN2
SCHEMBL8411539 0.73 SLC6A3 (0.36) ALDH1A1HPGDRAB9ASMN1; SMN2HSD17B10
SCHEMBL8386920 0.73 THRB (0.33)
SCHEMBL8195821 0.71 ALDH1A1 (0.38) ALDH1A1KMT2AHPGDRAB9ASMN1; SMN2

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
CN-105461666-B A kind of preparation method of 2 substituted tetrahydrofuran class compound 华东师范大学 2018-03-13 CN disclosed
CN-105461666-A Preparation method of 2-substituted tetrahydrofuran compounds UNIV EAST CHINA NORMAL 2016-04-06 CN disclosed
CN-105461666-A Preparation method of 2-substituted tetrahydrofuran compounds UNIV EAST CHINA NORMAL 2016-04-06 CN disclosed