SCHEMBL24499149

SCHEMBL24499149

O=C(c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(Br)ccc1-2)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 13/20 0.46
▸ CES1 P23141 1/20 0.42
▸ OPRM1 P35372 1/20 0.36
▸ OPRD1 P41143 1/20 0.36

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
SCHEMBL29540116 0.80 PDK2 (0.47) PDK2OPRM1OPRD1
SCHEMBL1307887 0.80 PDK2 (0.47) PDK2OPRM1OPRD1
SCHEMBL21560671 0.79 SMN1; SMN2 (0.42) PDK2OPRM1OPRD1
SCHEMBL12856610 0.79 PDK2 (0.52) PDK2CES1
SCHEMBL802764 0.75 PDK2 (0.51) PDK2OPRM1OPRD1
SCHEMBL29469448 0.75 PDK2 (0.51) PDK2OPRM1OPRD1
SCHEMBL22197216 0.74 PDK2 (0.44) PDK2OPRM1OPRD1
SCHEMBL28598017 0.74 SRD5A2 (0.56) PDK2CES1
SCHEMBL24730435 0.74 MEN1 (0.43) PDK2OPRM1OPRD1
SCHEMBL14681787 0.73 SRD5A2 (0.49) PDK2OPRM1OPRD1

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-2022120206-A2 ROOM-TEMPERATURE PHOSPHORESCENCE NANOPARTICLES AND METHODS OF MAKING THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2022-06-09 — — WO disclosed
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