SCHEMBL7635273

SCHEMBL7635273

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
PLK1 P53350 1/20 0.47
TDP1 Q9NUW8 1/20 0.45
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RAB9A P51151 2/20 0.43
LMNA P02545 2/20 0.42
F2 P00734 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
POLB P06746 2/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39

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
SCHEMBL36204 0.88 ALDH1A1 (0.64) ALDH1A1PLK1TDP1RXRARXRB
SCHEMBL7634659 0.88 PLK1 (0.49) ALDH1A1PLK1RAB9APOLBKMT2A
SCHEMBL7628268 0.85 TDP1 (0.52) ALDH1A1TDP1RAB9ALMNAF2
SCHEMBL7623926 0.85 RARB (0.51) ALDH1A1PLK1POLBHPGDKMT2A
SCHEMBL7637334 0.85 ALDH1A1 (0.55) ALDH1A1PLK1TDP1RXRARXRB
SCHEMBL7634780 0.84 ALDH1A1 (0.47) ALDH1A1PLK1TDP1RXRARXRB
SCHEMBL7637077 0.84 THRA (0.54) ALDH1A1KMT2AMEN1MAPT
SCHEMBL7633998 0.83 LMNA (0.65) ALDH1A1TDP1RAB9ALMNAF2
SCHEMBL7627402 0.82 THRA (0.56) ALDH1A1TDP1KMT2AMEN1MAPT
SCHEMBL7625811 0.82 CA1 (0.56) ALDH1A1RAB9ASMN1; SMN2KMT2AMEN1

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