SCHEMBL24969191

SCHEMBL24969191

CC1(C)c2ccccc2-c2cc(Nc3cccc4c3C(C)(C)c3cc(-c5ccccc5)ccc3-4)ccc21

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 17/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.34
▸ SIRT1 Q96EB6 1/20 0.34
▸ RARA P10276 1/20 0.33
▸ RARB P10826 1/20 0.33
▸ RARG P13631 1/20 0.33

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
SCHEMBL24969713 1.00 PDK2 (0.39) PDK2SIRT2SIRT1RARARARB
SCHEMBL24969186 0.90 PDK2 (0.40) PDK2SIRT2SIRT1RARARARB
SCHEMBL24969161 0.89 PDK2 (0.38) PDK2RARBRARG
SCHEMBL29771334 0.89 PDK2 (0.38) PDK2
SCHEMBL23648311 0.89 PDK2 (0.38) PDK2
SCHEMBL24969183 0.87 PTGER4 (0.37) SIRT2SIRT1RARARARBRARG
SCHEMBL16383445 0.86 SIRT2 (0.46) PDK2SIRT2SIRT1
SCHEMBL14681457 0.86 PDK2 (0.40) PDK2
SCHEMBL15892495 0.86 AKR1C3 (0.39) PDK2SIRT2SIRT1
SCHEMBL30076012 0.86 AKR1C3 (0.39) PDK2SIRT2SIRT1

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
Send feedback