SCHEMBL25849157

SCHEMBL25849157

CC1(C)c2ccccc2-c2cccc(-c3cccc4c3Oc3ccccc3C4(c3ccccc3)c3ccccc3)c21

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
OPRK1 P41145 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DRD1 P21728 1/20 0.33
KIF11 P52732 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
CFTR P13569 1/20 0.30
GOPC Q9HD26 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
PGR P06401 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
SCHEMBL22706587 0.89
SCHEMBL25856606 0.87 MEN1 (0.43) MAPTKDM4EMEN1LMNAOPRK1
SCHEMBL25848898 0.86 DRD1 (0.34) MAPTKDM4EMEN1LMNAOPRK1
SCHEMBL25852020 0.86 DRD1 (0.33) DRD1CFTRGOPCPGR
SCHEMBL25849160 0.86 KDM4E (0.33) MAPTKDM4EMEN1LMNAOPRK1
SCHEMBL25848988 0.84 MEN1 (0.38) MAPTKDM4EMEN1LMNAOPRK1
SCHEMBL25856760 0.84 MEN1 (0.40) MAPTKDM4EMEN1LMNAOPRK1
SCHEMBL25848907 0.83 DRD1 (0.38) MAPTKDM4EMEN1LMNAOPRK1
SCHEMBL25849432 0.83 DRD1 (0.35) MAPTKDM4EMEN1LMNAOPRK1
SCHEMBL25849629 0.83 DRD1 (0.35) MAPTKDM4EMEN1LMNAOPRK1

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