SCHEMBL25857625

SCHEMBL25857625

c1ccc(C2(c3ccccc3-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3c(ccc5ccccc35)O4)c3ccccc3-c3cc4ccccc4cc32)cc1

nearest known ligand 0.30

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
OPRK1 P41145 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
GPR84 Q9NQS5 1/20 0.30
PDK2 Q15119 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
SCHEMBL25856503 0.94 MCL1 (0.32) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25856761 0.93 KDM4E (0.35) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25865143 0.92 PDK2 (0.32) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25858621 0.90 PDK2 (0.32) PDK2
SCHEMBL25851324 0.90 PDK2 (0.32) PDK2
SCHEMBL25851412 0.89 PDK2 (0.33) PDK2
SCHEMBL25852022 0.89 PDK2 (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25865148 0.89 PDK2 (0.33) PDK2
SCHEMBL25851817 0.88 CHRNA1 (0.32)
SCHEMBL25851558 0.88 PDK2 (0.30) PDK2

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