SCHEMBL25849778

SCHEMBL25849778

c1ccc(C2(c3ccccc3)c3ccccc3-c3c(-c4cccc5c4C(c4ccccc4)(c4ccccc4)c4ccccc4O5)cccc32)cc1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
OPRK1 P41145 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33
CFTR P13569 1/20 0.32
GOPC Q9HD26 1/20 0.32
POLB P06746 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
SCHEMBL25849369 0.88 KDM4E (0.40) KDM4ELMNAMEN1KMT2AMAPT
SCHEMBL25848419 0.86 KDM4E (0.33) KDM4ELMNAMEN1KMT2AMAPT
SCHEMBL25847801 0.86 KDM4E (0.33) KDM4EMAPK1ATM
SCHEMBL25847571 0.86 KDM4E (0.36) KDM4ELMNAMEN1KMT2AMAPT
SCHEMBL25852821 0.86 KDM4E (0.33) KDM4ELMNAMEN1KMT2AMAPT
SCHEMBL25850331 0.85 KDM4E (0.32) KDM4EMAPK1ATM
SCHEMBL25849773 0.85 LMNA (0.37) KDM4ELMNAMEN1KMT2AMAPT
SCHEMBL25865774 0.84 KDM4E (0.41) KDM4ELMNAMEN1KMT2AMAPT
SCHEMBL23028774 0.84 MEN1 (0.35) KDM4ELMNAMEN1KMT2AMAPT
SCHEMBL22706038 0.84 KDM4E (0.30) KDM4ELMNAMEN1KMT2AMAPT

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-2023120714-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-29 WO disclosed