SCHEMBL24648458

SCHEMBL24648458

c1ccc(-c2cc(-c3ccc(-c4ccc5c(c4)Oc4cc(-c6ccc(-c7ccccn7)cc6)ccc4C54c5ccccc5-c5ccccc54)cc3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.40
MAPT P10636 6/20 0.39
RAB9A P51151 6/20 0.39
SMN1; SMN2 Q16637 6/20 0.39
TP53 P04637 4/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 3/20 0.39
PKM P14618 3/20 0.39
KDM4E B2RXH2 3/20 0.39
TSHR P16473 2/20 0.39
HSD17B10 Q99714 2/20 0.39
LMNA P02545 2/20 0.39
KLF5 Q13887 1/20 0.39
MAPK1 P28482 2/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
NTSR1 P30989 1/20 0.38
DHODH Q02127 1/20 0.36
NPC1 O15118 5/20 0.35
AURKA O14965 1/20 0.35

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
SCHEMBL24647899 0.99 PDK2 (0.42) PDK2MAPTRAB9ASMN1; SMN2TP53
SCHEMBL24648358 0.99 PDK2 (0.42) PDK2MAPTRAB9ASMN1; SMN2TP53
SCHEMBL24648455 0.97 PDK2 (0.41) PDK2MAPTRAB9ASMN1; SMN2TP53
SCHEMBL24648470 0.97 PDK2 (0.41) PDK2MAPTRAB9ASMN1; SMN2TP53
SCHEMBL24647897 0.96 PDK2 (0.41) PDK2MAPTRAB9ASMN1; SMN2TP53
SCHEMBL24647744 0.96 PDK2 (0.40) PDK2MAPTRAB9ASMN1; SMN2TP53
SCHEMBL19298253 0.95 RAB9A (0.37) PDK2MAPTRAB9ASMN1; SMN2TP53
SCHEMBL19299341 0.95 RAB9A (0.37) PDK2MAPTRAB9ASMN1; SMN2TP53
SCHEMBL24648469 0.94 PDK2 (0.44) PDK2MAPTRAB9ASMN1; SMN2TP53
SCHEMBL24518748 0.94 PDK2 (0.38) PDK2MAPTRAB9ASMN1; SMN2TP53

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
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed
US-20220376178-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2022-11-24 US disclosed