SCHEMBL17029070

SCHEMBL17029070

CC1(C)OB(c2cccc3c2C=Cc2ccccc2N3c2ccccc2)OC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 1/20 0.34
▸ LIPG Q9Y5X9 1/20 0.34
▸ JAK2 O60674 3/20 0.34
▸ BTK Q06187 3/20 0.34
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ RXFP1 Q9HBX9 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
SCHEMBL17029077 0.86 LPL (0.35) LPLLIPGJAK2BTKGAA
SCHEMBL17029083 0.78 LIPG (0.44) LPLLIPG
SCHEMBL17029071 0.78 LIPG (0.44) LPLLIPG
SCHEMBL28365136 0.78 LPL (0.41) LPLLIPGJAK2BTKGAA
SCHEMBL26471958 0.73 LPL (0.38) LPLLIPGJAK2BTK
SCHEMBL17072854 0.72 MEN1 (0.38) LPLLIPGJAK2BTKMAPT
SCHEMBL12320963 0.72 MGLL (0.46) GAAMAPTMAPK1ATMRXFP1
SCHEMBL17072956 0.71 GAA (0.47) LPLLIPGJAK2BTKGAA
SCHEMBL21410590 0.70 LPL (0.34) LPLLIPG
SCHEMBL28365135 0.70 LIPG (0.59) LPLLIPG

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-2015126156-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 — — WO disclosed
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