SCHEMBL14459910

SCHEMBL14459910

C=CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.46
▸ TP53 P04637 3/20 0.46
▸ PRCP P42785 1/20 0.45
▸ CASP3 P42574 2/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ MDM2 Q00987 2/20 0.42
▸ EPHX2 P34913 1/20 0.41

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
SCHEMBL18016107 0.90 MDM4 (0.46) MDM4TP53CASP3KMT2AMDM2
SCHEMBL30055032 0.86 MDM4 (0.48) MDM4TP53CASP3KMT2AMDM2
SCHEMBL26010138 0.85 PRCP (0.44) MDM4TP53PRCPCASP3KMT2A
SCHEMBL24414068 0.85 CASP3 (0.53) MDM4TP53CASP3KMT2AMDM2
SCHEMBL25182057 0.85 CASP3 (0.53) MDM4TP53CASP3KMT2AMDM2
SCHEMBL29709555 0.85 CASP3 (0.53) MDM4TP53CASP3KMT2AMDM2
SCHEMBL16289027 0.84 CASP3 (0.52) MDM4TP53CASP3KMT2AMDM2
SCHEMBL15083245 0.84 CASP3 (0.52) MDM4TP53CASP3KMT2AMDM2
SCHEMBL18016104 0.84 MDM4 (0.47) MDM4TP53PRCPCASP3KMT2A
SCHEMBL29855001 0.84 CASP3 (0.52) MDM4TP53CASP3KMT2AMDM2

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-2007093014-A1 METHODS FOR THE SYNTHESIS OF TWO OR MORE DICARBA BRIDGES IN ORGANIC COMPOUNDS MONASH UNIVERSITY (AU) 2007-08-23 — — WO disclosed
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