SCHEMBL24314671

SCHEMBL24314671

C1=Cc2c(oc3cccc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)c5ccccc45)c23)CC1

nearest known ligand 0.31

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.31
MAPT P10636 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
HPGD P15428 1/20 0.30
NFKB1 P19838 1/20 0.30
MAPK1 P28482 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
ATM Q13315 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 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
SCHEMBL26897346 0.91 TSHR (0.33) TSHRMAPTKDM4EALDH1A1TP53
SCHEMBL25652508 0.89 LMNA (0.31) TSHRMAPTLMNAPOLBHTT
SCHEMBL26043063 0.88 TSHR (0.33) TSHRMAPTKDM4EALDH1A1TP53
SCHEMBL26326502 0.88 TSHR (0.31) TSHRMAPTLMNAPOLBHTT
SCHEMBL25848346 0.87 PLA2G2A (0.31)
SCHEMBL25838179 0.87 TSHR (0.32) TSHRMAPTKDM4EALDH1A1TP53
SCHEMBL24971380 0.86 BACE1 (0.31) TSHRMAPTLMNAPOLBHTT
SCHEMBL24930813 0.86 TDP1 (0.34) TSHRMAPTKDM4EALDH1A1TP53
SCHEMBL24314952 0.86 ALDH1A1 (0.30) TSHRALDH1A1HPGDMAPK1HSD17B10
SCHEMBL25846679 0.86

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
EP-3972001-A1 ORGANIC LIGHT EMITTING DEVICE LG Chem, Ltd. (KR) 2022-03-23 EP disclosed