SCHEMBL19089830

SCHEMBL19089830

C=Cc1ccc(N(c2ccc(-c3ccc(C45CC6CC(CC(C6)C4)C5)cc3)cc2)c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
PTPN11 Q06124 1/20 0.31
RARB P10826 1/20 0.30
GAA P10253 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
SCHEMBL19098021 0.92 LMNA (0.36) ALDH1A1LMNAGAA
SCHEMBL19098342 0.92 LMNA (0.36) ALDH1A1LMNAGAA
SCHEMBL19098029 0.92 LMNA (0.36) ALDH1A1LMNAGAA
SCHEMBL19098244 0.90 LMNA (0.35) ALDH1A1LMNAGAA
SCHEMBL27267276 0.90 LMNA (0.35) ALDH1A1LMNARARBGAA
SCHEMBL19089960 0.90 LMNA (0.35) ALDH1A1LMNAGAA
SCHEMBL19089907 0.90 LMNA (0.35) ALDH1A1LMNAGAA
SCHEMBL19090001 0.90 LMNA (0.35) ALDH1A1LMNAGAA
SCHEMBL23601192 0.89 LMNA (0.37) ALDH1A1LMNAGAA
SCHEMBL20648579 0.89 LMNA (0.34) ALDH1A1LMNAGAA

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
WO-2017116168-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 머티어리얼사이언스 주식회사 2017-07-06 WO disclosed