SCHEMBL7633916

SCHEMBL7633916

CCCCCC[C](C)OOC(=O)c1ccc(OC(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.45
PARP10 Q53GL7 1/20 0.44
MAPT P10636 3/20 0.43
NPSR1 Q6W5P4 1/20 0.43
POLB P06746 1/20 0.42
STS P08842 9/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
TP53 P04637 2/20 0.40
TSHR P16473 1/20 0.40
MGLL Q99685 1/20 0.40
ALDH1A1 P00352 1/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL7631122 0.85 CA1 (0.47) STSTP53TSHRMGLLALDH1A1
SCHEMBL7627678 0.85 TP53 (0.57) TP53TSHRTHRB
SCHEMBL7627647 0.84 NPC1 (0.43) MAPTSTSTSHRALDH1A1
SCHEMBL7631376 0.84 TP53 (0.60) TP53TSHRTHRB
SCHEMBL7633506 0.84 NPC1 (0.51) KMT2APARP10TP53TSHRALDH1A1
SCHEMBL7625317 0.83 KMT2A (0.53) KMT2APARP10MAPTNPSR1POLB
SCHEMBL7632887 0.83 L3MBTL1 (0.55) TP53TSHRTHRB
SCHEMBL7625804 0.82 L3MBTL1 (0.48) KMT2AMAPTSTSTSHRALDH1A1
SCHEMBL7628403 0.82 HSD17B3 (0.44) KMT2AMAPTALDH1A1THRB
SCHEMBL7625349 0.80 CES2 (0.55) KMT2AMAPTTSHRALDH1A1HTT

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
EP-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed