SCHEMBL27637562

SCHEMBL27637562

CC(C)C(NC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.51
▸ CASP3 P42574 4/20 0.50
▸ MDM4 O15151 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ EPHX2 P34913 1/20 0.44
▸ TLR2 O60603 2/20 0.43

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
SCHEMBL8902890 1.00 KMT2A (0.51) KMT2ACASP3MDM4TP53EPHX2
SCHEMBL29697708 1.00 KMT2A (0.51) KMT2ACASP3MDM4TP53EPHX2
SCHEMBL29603695 1.00 KMT2A (0.51) KMT2ACASP3MDM4TP53EPHX2
SCHEMBL29376420 0.92 KMT2A (0.50) KMT2ACASP3MDM4TP53EPHX2
SCHEMBL24580473 0.91 KMT2A (0.49) KMT2ACASP3EPHX2
SCHEMBL30560164 0.91 CASP3 (0.53) KMT2ACASP3MDM4TP53EPHX2
SCHEMBL31546963 0.89 KMT2A (0.57) KMT2ACASP3MDM4TP53EPHX2
SCHEMBL18429471 0.88 KMT2A (0.53) KMT2ACASP3MDM4TP53EPHX2
SCHEMBL1668211 0.88 KMT2A (0.53) KMT2ACASP3MDM4TP53EPHX2
SCHEMBL30028151 0.88 KMT2A (0.53) KMT2ACASP3MDM4TP53EPHX2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100423827-C Method of reacting two-phase solution changing in phase state with temperature change and apparatus for practicing the same JAPAN SCIENCE & TECH AGENCY (JP) 2008-10-08 — — CN disclosed
CN-1863590-A Method of reacting two-phase solution changing in phase state with temperature change and apparatus for practicing the same JAPAN SCIENCE & TECH AGENCY (JP) 2006-11-15 — — CN disclosed
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