SCHEMBL18714596

SCHEMBL18714596

CCCCOC1O[C@@H]2OC(C)(C)O[C@@H]12

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
THPO P40225 1/20 0.42
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 2/20 0.40
CA2 P00918 2/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
GLB1 P16278 1/20 0.33
PPP5C P53041 1/20 0.31
CYP2C9 P11712 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
SCHEMBL6919792 0.78 GJB2 (0.33) LMNACYP1A2THPOKMT2AALDH1A1
SCHEMBL14479995 0.75 LMNA (0.51) LMNACYP1A2THPOKMT2AALDH1A1
SCHEMBL6813338 0.75 LMNA (0.35) LMNACYP1A2THPOKMT2AALDH1A1
SCHEMBL18125669 0.75 LMNA (0.51) LMNACYP1A2THPOKMT2AALDH1A1
SCHEMBL13855890 0.74 LMNA (0.44) LMNACYP1A2THPOKMT2AALDH1A1
SCHEMBL14853736 0.74 LMNA (0.44) LMNACYP1A2THPOKMT2AALDH1A1
SCHEMBL15948695 0.74 LMNA (0.44) LMNACYP1A2THPOKMT2AALDH1A1
SCHEMBL12924471 0.74 LMNA (0.44) LMNACYP1A2THPOKMT2AALDH1A1
SCHEMBL13456773 0.74 LMNA (0.44) LMNACYP1A2THPOKMT2AALDH1A1
SCHEMBL12725400 0.74 LMNA (0.44) LMNACYP1A2THPOKMT2AALDH1A1

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-9611479-B2 Crosslinked nucleoside and nucleotide OSAKA UNIVERSITY (JP) 2017-04-04 US disclosed