SCHEMBL25830758

SCHEMBL25830758

C1=CC(c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5cc(-c6ccc(-c7ccccc7)cc6)cc6oc7ccccc7c56)n4)cc3)cc2)=CCC1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.31
MAPT P10636 3/20 0.30
KMT2A Q03164 2/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
HTT P42858 1/20 0.30
MEN1 O00255 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL26298588 0.97 MMP12 (0.31) TSHR
SCHEMBL25829268 0.95 KDM4E (0.33) KMT2AMEN1
SCHEMBL25651689 0.95 TSHR (0.32) TSHRMAPTKMT2ALMNAPOLB
SCHEMBL25832618 0.94 MAPT (0.31) TSHRMAPTLMNAPOLBNPSR1
SCHEMBL26066809 0.93 KDM4E (0.31) TSHRMAPTKMT2A
SCHEMBL26038070 0.92 TSHR (0.30) TSHR
SCHEMBL23312760 0.91 TSHR (0.32) TSHRMAPTKMT2ALMNAPOLB
SCHEMBL25651520 0.91 KDM4E (0.34) TSHRKMT2AMEN1
SCHEMBL25670823 0.91
SCHEMBL24972754 0.90 KDM4E (0.33) KMT2AMEN1

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed