SCHEMBL21668671

SCHEMBL21668671

CC(C)(O)C(C)(C)OBc1ccc2c(c1)oc1c(-n3c4ccccc4c4ccccc43)cccc12

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
DYRK1A Q13627 1/20 0.30
GGPS1 O95749 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
SCHEMBL27450373 0.88 NPC1 (0.32)
SCHEMBL23564513 0.82 SLC5A1 (0.31)
SCHEMBL24054519 0.82 ALDH1A1 (0.32) MEN1CYP2C19KMT2A
SCHEMBL23031481 0.81 DYRK1A (0.32) DYRK1A
SCHEMBL21968791 0.81 AHR (0.41) MEN1CYP2C19KMT2A
SCHEMBL23948012 0.80 TTR (0.39) MEN1CYP2C19KMT2ADYRK1A
SCHEMBL19660360 0.79 KDM4E (0.35) MEN1CYP2C19KMT2ADYRK1A
SCHEMBL23987485 0.78 KMT2A (0.34) MEN1CYP2C19KMT2ADYRK1AGGPS1
SCHEMBL25073022 0.78 ALOX5 (0.44) MEN1CYP2C19KMT2ADYRK1AGGPS1
SCHEMBL16441971 0.78 KDM4E (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3611173-B1 ORGANIC LIGHT EMITTING ELEMENT AND COMPOSITION FOR ORGANIC MATERIAL LAYER IN ORGANIC LIGHT EMITTING ELEMENT LT MATERIALS CO LTD (KR) 2021-07-28 EP disclosed
EP-3611173-A1 ORGANIC LIGHT EMITTING ELEMENT AND COMPOSITION FOR ORGANIC MATERIAL LAYER IN ORGANIC LIGHT EMITTING ELEMENT Heesung Material Ltd. (KR) 2020-02-19 EP disclosed
EP-3604297-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME Heesung Material Ltd. (KR) 2020-02-05 EP disclosed