SCHEMBL25849432

SCHEMBL25849432

CC1(C)c2ccccc2-c2ccc(-c3cccc4c3Oc3ccccc3C4(c3ccccc3)c3ccccc3)cc21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.35
PDK2 Q15119 5/20 0.32
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
OPRK1 P41145 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
PLIN1 O60240 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PLIN5 Q00G26 1/20 0.30
ABHD5 Q8WTS1 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL25849629 0.93 DRD1 (0.35) DRD1MAPTKDM4EMEN1LMNA
SCHEMBL25867422 0.92 PDK2 (0.32) DRD1PDK2MAPTKDM4EMEN1
SCHEMBL25849522 0.91 PDK2 (0.34) DRD1PDK2
SCHEMBL25849163 0.90 DRD1 (0.37) DRD1PDK2MAPTKDM4EMEN1
SCHEMBL25849314 0.89 PDK2 (0.32) PDK2MAPTKDM4EMEN1LMNA
SCHEMBL25849244 0.89 MEN1 (0.36) PDK2MAPTKDM4EMEN1LMNA
SCHEMBL25847399 0.89 MEN1 (0.36) PDK2MAPTKDM4EMEN1LMNA
SCHEMBL25852483 0.88 DRD1 (0.35) DRD1PDK2
SCHEMBL25872074 0.88 PDK2 (0.33) DRD1PDK2MAPTKDM4EMEN1
SCHEMBL25849426 0.87 DRD1 (0.39) DRD1PDK2

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