SCHEMBL20933111

SCHEMBL20933111

CC1(C)c2ccccc2-c2c1ccc1c2Oc2c(cccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccccc5)cc4)n3)cc2)O1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.33
PDK2 Q15119 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
GPR55 Q9Y2T6 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 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
SCHEMBL20933112 1.00 DRD1 (0.33) DRD1PDK2L3MBTL1GPR55LMNA
SCHEMBL20933107 0.99 DRD1 (0.33) DRD1PDK2L3MBTL1GPR55LMNA
SCHEMBL20934422 0.97 PDK2 (0.32) DRD1PDK2L3MBTL1GPR55LMNA
SCHEMBL20934421 0.97 PDK2 (0.32) DRD1PDK2L3MBTL1GPR55LMNA
SCHEMBL20933105 0.96 DRD1 (0.30) DRD1
SCHEMBL20933969 0.96 DRD1 (0.30) DRD1
SCHEMBL20933737 0.96 DRD1 (0.32) DRD1PDK2L3MBTL1GPR55LMNA
SCHEMBL20934397 0.95 DRD1 (0.33) DRD1PDK2L3MBTL1
SCHEMBL20934372 0.95 DRD1 (0.33) DRD1PDK2L3MBTL1
SCHEMBL20934415 0.95 PDK2 (0.33) DRD1PDK2L3MBTL1GPR55LMNA

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-2019078461-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2019-04-25 WO disclosed