SCHEMBL17230482

SCHEMBL17230482

CC(C)Oc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 3/20 0.58
ACR P10323 3/20 0.58
KMT2A Q03164 2/20 0.51
PARP10 Q53GL7 1/20 0.50
MAPT P10636 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CYP3A4 P08684 1/20 0.48
CYP3A5 P20815 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
PTPN5 P54829 1/20 0.48
KIF11 P52732 1/20 0.46
NR1H4 Q96RI1 1/20 0.46
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 2/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL28639038 0.87 PRSS1 (0.71) PRSS1ACRKMT2APARP10MAPT
SCHEMBL9682438 0.87 PRSS1 (0.71) PRSS1ACRKMT2APARP10MAPT
SCHEMBL8984330 0.87 KMT2A (0.66) PRSS1ACRKMT2APARP10MAPT
SCHEMBL11059672 0.83 PRSS1 (0.62) PRSS1ACRKMT2AMAPTTDP1
SCHEMBL8058452 0.83 LMNA (0.63) PRSS1ACRKMT2AMAPTTDP1
SCHEMBL8072562 0.83 LMNA (0.63) PRSS1ACRKMT2AMAPTTDP1
SCHEMBL21771902 0.83 MAPT (0.71) PRSS1ACRKMT2AMAPTTDP1
SCHEMBL178405 0.82 CYP3A4 (0.58) KMT2APARP10CYP3A4CYP3A5PTPN5
SCHEMBL17230478 0.81 KMT2A (0.62) PRSS1ACRKMT2APARP10MAPT
SCHEMBL22490558 0.81 LMNA (0.60) PRSS1ACRKMT2APARP10MAPT

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
US-20150316844-A1 CURABLE COMPOSITION AND COLOR FILTER FUJIFILM CORPORATION (JP) 2015-11-05 US disclosed