SCHEMBL7794269

SCHEMBL7794269

CCCCCOC[C@H]1OC(OCCCCC)C[C@@H]1OCCCCC

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ GJB2 P29033 4/20 0.37
▸ PTAFR P25105 1/20 0.37
▸ GBA1 P04062 1/20 0.35
▸ PPP5C P53041 1/20 0.35
▸ LMNA P02545 1/20 0.33
▸ SSTR1 P30872 1/20 0.32
▸ SSTR2 P30874 1/20 0.32
▸ SSTR4 P31391 1/20 0.32
▸ SSTR3 P32745 1/20 0.32
▸ SSTR5 P35346 1/20 0.32
▸ SPHK2 Q9NRA0 1/20 0.32
▸ SPHK1 Q9NYA1 1/20 0.32

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
SCHEMBL7794271 1.00 ALDH1A1 (0.44) ALDH1A1TDP1SMN1; SMN2GJB2PTAFR
SCHEMBL5008878 0.91 ALDH1A1 (0.41) ALDH1A1TDP1SMN1; SMN2GJB2PTAFR
SCHEMBL10765035 0.91 ALDH1A1 (0.41) ALDH1A1TDP1SMN1; SMN2GJB2PTAFR
SCHEMBL5008877 0.91 ALDH1A1 (0.41) ALDH1A1TDP1SMN1; SMN2GJB2PTAFR
SCHEMBL3979922 0.88 ALDH1A1 (0.40) ALDH1A1TDP1SMN1; SMN2GJB2PTAFR
SCHEMBL12000846 0.86 SMN1; SMN2 (0.41) ALDH1A1TDP1SMN1; SMN2GJB2PPP5C
SCHEMBL14580119 0.86 SMN1; SMN2 (0.41) ALDH1A1TDP1SMN1; SMN2GJB2PPP5C
SCHEMBL17867772 0.81 GJB2 (0.42) ALDH1A1TDP1SMN1; SMN2GJB2GBA1
SCHEMBL17867773 0.81 GJB2 (0.42) ALDH1A1TDP1SMN1; SMN2GJB2GBA1
SCHEMBL14038310 0.79 SMN1; SMN2 (0.43) ALDH1A1TDP1SMN1; SMN2GJB2PPP5C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0777674-B1 POLYNUCLEOTIDE REAGENTS HAVING NONNUCLEOTIDIC MOIETIES, AND ASSOCIATED METHODS OF SYNTHESIS AND USE BAYER AG (US) 2001-11-28 — — EP disclosed
EP-0777674-A1 POLYNUCLEOTIDE REAGENTS HAVING NONNUCLEOTIDIC MOIETIES, AND ASSOCIATED METHODS OF SYNTHESIS AND USE CHIRON CORPORATION (US) 1997-06-11 — — EP disclosed
US-5597909-A Polynucleotide reagents containing modified deoxyribose moieties, and associated methods of synthesis and use CHIRON CORPORATION (US) 1997-01-28 — — US disclosed
US-5594117-A Polynucleotide reagents containing modified deoxyribose moieties and associated methods of synthesis and use CHIRON CORPORATION (US) 1997-01-14 — — US disclosed
WO-1996006104-A1 POLYNUCLEOTIDE REAGENTS HAVING NONNUCLEOTIDIC MOIETIES, AND ASSOCIATED METHODS OF SYNTHESIS AND USE CHIRON CORPORATION (US) 1996-02-29 — — WO disclosed
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