SCHEMBL7637236

SCHEMBL7637236

C[C](COC(C)(C)C)OOC(=O)c1ccc(C(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
USP5 P45974 1/20 0.39
PRSS1 P07477 1/20 0.37
ACR P10323 1/20 0.37
ALDH1A1 P00352 5/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
POLB P06746 1/20 0.36
CYP2C9 P11712 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HPGD P15428 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
CYP2D6 P10635 1/20 0.34
HIF1A Q16665 1/20 0.34

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
SCHEMBL7636911 0.84 TDP1 (0.44) KMT2AALDH1A1TSHRHSD17B10TDP1
SCHEMBL7628407 0.84 SMN1; SMN2 (0.49) MEN1KMT2AUSP5PRSS1ACR
SCHEMBL7637287 0.82 ALDH1A1 (0.43) MEN1KMT2AALDH1A1TSHRHSD17B10
SCHEMBL7623941 0.82 CA1 (0.46) PRSS1ACRALDH1A1TSHRHSD17B10
SCHEMBL7624126 0.82 TDP1 (0.57) KMT2AALDH1A1TSHRHSD17B10TDP1
SCHEMBL7630626 0.81 CA1 (0.49) MEN1KMT2AALDH1A1HSD17B10TDP1
SCHEMBL7629320 0.80 USP5 (0.44) MEN1KMT2AUSP5PRSS1ACR
SCHEMBL7626372 0.80 ALDH1A1 (0.47) ALDH1A1TSHRHSD17B10TDP1SMN1; SMN2
SCHEMBL7629431 0.80 TSHR (0.37) MEN1KMT2AALDH1A1TSHRHSD17B10
SCHEMBL23404253 0.79 CYP2C9 (0.52) MEN1KMT2AUSP5PRSS1ACR

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