SCHEMBL25849165

SCHEMBL25849165

CC1(C)c2ccccc2Oc2cccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c21

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
OPRK1 P41145 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
PDK2 Q15119 9/20 0.33
RARB P10826 2/20 0.32
RXRA P19793 2/20 0.32
RARG P13631 1/20 0.32
CTSD P07339 2/20 0.31
BACE1 P56817 2/20 0.31
RARA P10276 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 1/20 0.30
DRD1 P21728 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
SCHEMBL25850072 0.93 KDM4E (0.38) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25847396 0.92 PDK2 (0.35) PDK2RARBRXRARARGCTSD
SCHEMBL25857531 0.91 ESR1 (0.37) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25858163 0.91 MEN1 (0.41) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25852123 0.89 KDM4E (0.34) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25872286 0.89 KDM4E (0.36) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849240 0.88 MEN1 (0.37) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849243 0.88 MEN1 (0.37) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849246 0.88 PDK2 (0.33) PDK2RARBRXRARARGCTSD
SCHEMBL25849166 0.87 KDM4E (0.36) KDM4EMEN1LMNAMAPTOPRK1

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