SCHEMBL29292807

SCHEMBL29292807

Clc1ccc2c(c1)Sc1cc(Nc3ccc(-c4ccccc4)cc3)ccc1C21c2ccccc2-c2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.37
TP53 P04637 2/20 0.36
IDO1 P14902 1/20 0.34
CYP1A2 P05177 1/20 0.33
EGFR P00533 1/20 0.33
GRIK1 P39086 1/20 0.33
PGR P06401 1/20 0.33
RPS6KA3 P51812 1/20 0.33
CNR1 P21554 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
GSK3B P49841 1/20 0.32
AGPAT2 O15120 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL22891733 0.90 PDK2 (0.40) PDK2MEN1KMT2AMAPT
SCHEMBL22891740 0.89 PDK2 (0.42) PDK2CYP1A2MEN1KMT2AMAPT
SCHEMBL26634459 0.84 PDK2 (0.42) PDK2CYP1A2PGR
SCHEMBL23382843 0.84 PDK2 (0.40) PDK2TP53CYP1A2MEN1KMT2A
SCHEMBL22589581 0.83 PDK2 (0.46) PDK2CYP1A2EGFRMEN1KMT2A
SCHEMBL24723585 0.82 PDK2 (0.39) PDK2EGFRCNR1MEN1KMT2A
SCHEMBL23637457 0.82 PDK2 (0.43) PDK2MEN1KMT2AMAPT
SCHEMBL24027782 0.80 PDK2 (0.39) PDK2TP53CYP1A2
SCHEMBL23372318 0.80 PDK2 (0.44) PDK2TP53CYP1A2MEN1KMT2A
SCHEMBL22245913 0.80 PDK2 (0.47) PDK2CYP1A2MEN1KMT2AMAPT

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
EP-4269406-B1 COMPOUND FOR ORGANIC ELECTRICAL ELEMENT, ORGANIC ELECTRICAL ELEMENT USING SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO LTD (KR) 2024-07-10 EP disclosed