SCHEMBL24969748

SCHEMBL24969748

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3ccc(Cl)cc3-4)cc21

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 12/20 0.50
PGR P06401 5/20 0.41
S100A4 P26447 1/20 0.40
AKR1A1 P14550 1/20 0.39
AKR1B1 P15121 1/20 0.39

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
SCHEMBL20927640 0.93 PDK2 (0.51) PDK2PGRAKR1A1AKR1B1
SCHEMBL30865781 0.90 PDK2 (0.59) PDK2PGR
SCHEMBL12362762 0.90 PDK2 (0.59) PDK2PGR
SCHEMBL24665388 0.90 PDK2 (0.59) PDK2PGR
SCHEMBL20806340 0.90 PDK2 (0.56) PDK2PGRS100A4AKR1A1AKR1B1
SCHEMBL19849937 0.90 PDK2 (0.59) PDK2PGRS100A4AKR1A1AKR1B1
SCHEMBL19928405 0.88 PDK2 (0.44) PDK2
SCHEMBL17326962 0.87 PDK2 (0.61) PDK2PGR
SCHEMBL25818397 0.87 PDK2 (0.41) PDK2PGRS100A4AKR1A1AKR1B1
SCHEMBL30055951 0.87 PDK2 (0.51) PDK2PGR

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-2023003234-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-01-26 WO disclosed