SCHEMBL25949539

SCHEMBL25949539

C1=Cc2cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc43)ccc2CC1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
EDNRB P24530 1/20 0.30
EDNRA P25101 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
SCHEMBL26202712 0.87 KDM4E (0.43) EDNRBEDNRA
SCHEMBL26048841 0.86 KDM4E (0.42) EDNRBEDNRA
SCHEMBL21923146 0.82 KDM4E (0.41) CNR1CNR2EDNRBEDNRA
SCHEMBL19267093 0.82 ALDH1A1 (0.31)
SCHEMBL24232577 0.81 TDP1 (0.30)
SCHEMBL15436115 0.80 KDM4E (0.46) CNR1CNR2EDNRBEDNRA
SCHEMBL26451119 0.79 KDM4E (0.39)
SCHEMBL18623557 0.79 KDM4E (0.44) CNR1CNR2EDNRBEDNRA
SCHEMBL15435773 0.79 KDM4E (0.44) CNR1CNR2EDNRBEDNRA
SCHEMBL25570224 0.79 EDNRB (0.32) EDNRBEDNRA

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-4212526-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LT Materials Co., Ltd. (KR) 2023-07-19 EP disclosed