SCHEMBL24968643

SCHEMBL24968643

CC1(C)c2ccc(-c3ccccc3)cc2-c2cccc(Nc3ccccc3C3(c4ccccc4)c4ccccc4-c4ccccc43)c21

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ RARA P10276 1/20 0.30
▸ RARB P10826 1/20 0.30
▸ RARG P13631 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
SCHEMBL22245925 0.83 PDK2 (0.37) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL24969183 0.81 PTGER4 (0.37) KDM4EMEN1LMNAMAPTKMT2A
SCHEMBL25125244 0.81 PDK2 (0.35) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL25124816 0.80 FABP4 (0.43) PDK2LMNASMN1; SMN2
SCHEMBL24969713 0.78 PDK2 (0.39) PDK2RARARARBRARG
SCHEMBL24969191 0.78 PDK2 (0.39) PDK2RARARARBRARG
SCHEMBL23696740 0.77 SIRT2 (0.46) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL16383445 0.77 SIRT2 (0.46) PDK2KDM4EMEN1MAPTKMT2A
SCHEMBL15892495 0.77 AKR1C3 (0.39) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL30076012 0.77 AKR1C3 (0.39) PDK2KDM4EMEN1LMNAMAPT

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
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