SCHEMBL22907613

SCHEMBL22907613

c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc3c(c2)Oc2cc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccccc6)ccc54)ccc2N3c2ccc3sc4ccccc4c3c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
LIMK1 P53667 1/20 0.32
PIM3 Q86V86 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
SCHEMBL22907614 0.98 EDNRB (0.34) EDNRBEDNRALIMK1PIM3
SCHEMBL22907556 0.94 EDNRB (0.30) EDNRBEDNRA
SCHEMBL22907554 0.92 KIF11 (0.31)
SCHEMBL22907616 0.90 G6PD (0.31)
SCHEMBL22907536 0.88 GPR3 (0.35) EDNRBEDNRA
SCHEMBL13827528 0.86 LIMK1 (0.37) LIMK1PIM3
SCHEMBL15470168 0.86 LIMK1 (0.37) LIMK1PIM3
SCHEMBL14649092 0.86 GPR3 (0.40) EDNRBEDNRALIMK1PIM3
SCHEMBL14733830 0.86 GPR3 (0.40) EDNRBEDNRALIMK1PIM3
SCHEMBL22907698 0.86 PIM3 (0.32) LIMK1PIM3

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
US-20210020854-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-01-21 US disclosed