SCHEMBL22916638

SCHEMBL22916638

c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3cccc4oc5cc(-n6c7ccccc7c7ccccc76)ccc5c34)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 3/20 0.35
TP53 P04637 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 2/20 0.33
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32
TUBB3 Q13509 1/20 0.32
TUBB2A Q13885 1/20 0.32
TUBB8 Q3ZCM7 1/20 0.32
TUBA3E Q6PEY2 1/20 0.32
TUBA1A Q71U36 1/20 0.32

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
SCHEMBL21666766 0.97 TUBB4A (0.34) ALDH1A1KDM4EMAPTTUBB4ATUBB
SCHEMBL23203945 0.96 ALDH1A1 (0.33) ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10
SCHEMBL21862741 0.95 ALDH1A1 (0.32) ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10
SCHEMBL21667015 0.95 PGR (0.32) ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10
SCHEMBL23058286 0.94 ALDH1A1 (0.32) ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10
SCHEMBL24363571 0.94 ALDH1A1 (0.33) ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10
SCHEMBL21666815 0.94 PGR (0.31) ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10
SCHEMBL24363374 0.94 PTGER4 (0.34) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL21667149 0.94 PTGER4 (0.34) ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10
SCHEMBL21667054 0.94 KDM4E (0.36) ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4243102-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-09-13 EP disclosed
WO-2023287228-A1 ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2023-01-19 WO disclosed
WO-2021182833-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-09-16 WO disclosed
WO-2021182834-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-09-16 WO disclosed
WO-2021015603-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-01-28 WO disclosed