SCHEMBL29940665

SCHEMBL29940665

CC1(C)OB(c2cccc(-c3cc(-c4ccccc4)ccn3)c2)OC1(C)C

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 9/20 0.53
LPL P06858 8/20 0.53
PIM1 P11309 1/20 0.39
DGAT1 O75907 1/20 0.39
ASIC3 Q9UHC3 2/20 0.36
PDGFRB P09619 1/20 0.35
KDR P35968 1/20 0.35
P4HB P07237 1/20 0.35
SMO Q99835 2/20 0.34
TGFBR1 P36897 1/20 0.34
KMO O15229 1/20 0.34

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
SCHEMBL20598797 1.00 LIPG (0.53) LIPGLPLPIM1DGAT1ASIC3
SCHEMBL19766317 0.99 LIPG (0.55) LIPGLPLPIM1DGAT1ASIC3
SCHEMBL20127858 0.89 LIPG (0.53) LIPGLPLPIM1DGAT1ASIC3
SCHEMBL23487738 0.88 LIPG (0.67) LIPGLPLPIM1DGAT1ASIC3
SCHEMBL29634298 0.85 LIPG (0.70) LIPGLPLDGAT1PDGFRBKDR
SCHEMBL3362199 0.85 LIPG (0.70) LIPGLPLDGAT1PDGFRBKDR
SCHEMBL808246 0.85 LIPG (0.49) LIPGLPLDGAT1
SCHEMBL30919897 0.85 LIPG (0.49) LIPGLPLDGAT1
SCHEMBL31134246 0.85 LIPG (0.49) LIPGLPLDGAT1
SCHEMBL2216147 0.84 LIPG (0.56) LIPGLPLPIM1DGAT1ASIC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109216570-B Organic light emitting device 三星电子株式会社 2023-04-07 CN disclosed
CN-109326733-B Organic light emitting device 三星电子株式会社 2022-09-06 CN disclosed