SCHEMBL23028702

SCHEMBL23028702

CC1(C)c2ccccc2-c2cc(-c3ccc(C45c6ccccc6Oc6cccc(c64)Oc4ccccc45)cc3)ccc21

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
OPRK1 P41145 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
PDK2 Q15119 7/20 0.32
ELANE P08246 2/20 0.31
BACE1 P56817 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
SCHEMBL25849632 0.88 DRD1 (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849631 0.87 KDM4E (0.36) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849636 0.86 DRD1 (0.32) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849633 0.86 MEN1 (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL23028895 0.85 MEN1 (0.43) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849635 0.85 PDK2 (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849627 0.84 FTO (0.35) MEN1LMNAMAPTKMT2APDK2
SCHEMBL25850075 0.83 MEN1 (0.40) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25858166 0.83 MEN1 (0.40) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849629 0.82 DRD1 (0.35) 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-2021034089-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-25 WO disclosed