SCHEMBL15046238

SCHEMBL15046238

CC(=O)P(=O)(C(C)=O)c1ccc(-c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccccc2N4c2ccccc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 5/20 0.33
▸ PGR P06401 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ HSD17B3 P37058 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
SCHEMBL15046325 0.85 PGR (0.35) PDK2PGRALDH1A1
SCHEMBL15046242 0.85 PGR (0.35) PDK2PGRALDH1A1
SCHEMBL15019833 0.82 PGR (0.36) PDK2PGRALDH1A1
SCHEMBL19042757 0.82 PDK2 (0.39) PDK2PGR
SCHEMBL16900616 0.82 PGR (0.40) PDK2PGRALDH1A1
SCHEMBL16900626 0.81 PGR (0.42) PDK2PGRALDH1A1
SCHEMBL19368063 0.81 PGR (0.36) PDK2PGR
SCHEMBL19381067 0.81 PDK2 (0.37) PDK2PGRALDH1A1
SCHEMBL15046375 0.81 PGR (0.34) PDK2PGRALDH1A1
SCHEMBL15046373 0.81 PDK2 (0.45) PDK2PGRALDH1A1

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-2013089460-A1 NOVEL CHEMICAL COMPOUND HAVING AN ACRIDINE STRUCTURE, AND ORGANIC LIGHT-EMITTING DIODE USING SAME 주식회사 두산 (KR) 2013-06-20 — — WO disclosed
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