SCHEMBL25850540

SCHEMBL25850540

CC1(C)c2ccccc2Oc2c(-c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4-c4ccc5ccccc5c43)cccc21

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.32
ENPP1 P22413 1/20 0.32
DRD1 P21728 1/20 0.32
PDK2 Q15119 1/20 0.31

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
SCHEMBL25867130 1.00 ENPP3 (0.32) ENPP3ENPP1DRD1PDK2
SCHEMBL25850390 0.95 DRD1 (0.31) DRD1
SCHEMBL25867132 0.93 DRD1 (0.32) ENPP3ENPP1DRD1
SCHEMBL25867213 0.91 ENPP3 (0.33) ENPP3ENPP1DRD1PDK2
SCHEMBL25872290 0.90 PDK2 (0.31) ENPP3ENPP1PDK2
SCHEMBL25863674 0.90 PDK2 (0.32) ENPP3ENPP1PDK2
SCHEMBL25850632 0.89 PDK2 (0.32) ENPP3ENPP1PDK2
SCHEMBL25847573 0.89 ENPP3 (0.31) ENPP3ENPP1DRD1
SCHEMBL25850633 0.88 PDK2 (0.31) ENPP3ENPP1PDK2
SCHEMBL25872807 0.88 CA12 (0.32) ENPP3ENPP1PDK2

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