SCHEMBL10348376

SCHEMBL10348376

Cc1cc(OO)ccc1C(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.49
PLA2G1B P04054 1/20 0.49
ATG4B Q9Y4P1 1/20 0.49
KDM4E B2RXH2 3/20 0.47
CARM1 Q86X55 1/20 0.47
KMT2A Q03164 5/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
FKBP1A P62942 1/20 0.44
MEN1 O00255 3/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 2/20 0.42
GAA P10253 1/20 0.42
TRPA1 O75762 1/20 0.41
CHRM1 P11229 1/20 0.41
SLC6A2 P23975 1/20 0.41
ADRA1A P35348 1/20 0.41
HTR2B P41595 1/20 0.41
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL4220231 0.83 LMNA (0.39) TDP1PLA2G1BATG4BLMNATRPA1
SCHEMBL28984986 0.83 KDM4E (0.50) TDP1PLA2G1BATG4BKDM4ECARM1
SCHEMBL15086621 0.81 KMT2A (0.50) TDP1PLA2G1BATG4BKDM4ECARM1
SCHEMBL848282 0.81 KDM4E (0.49) TDP1PLA2G1BATG4BKDM4ECARM1
SCHEMBL9946003 0.81 TDP1 (0.54) TDP1PLA2G1BATG4BKDM4ECARM1
SCHEMBL25729964 0.79 KDM4E (0.47) TDP1PLA2G1BATG4BKDM4ECARM1
SCHEMBL27019642 0.79 CASP1 (0.46) TDP1PLA2G1BATG4BKDM4ECARM1
SCHEMBL18738950 0.78 KDM4E (0.46) TDP1PLA2G1BATG4BKDM4ECARM1
SCHEMBL11781255 0.78 ALDH1A1 (0.37) TDP1KDM4ECARM1KMT2AMEN1
SCHEMBL12883131 0.78 TDP1 (0.48) TDP1PLA2G1BATG4BKDM4ECARM1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0121192-B1 ANALYTICAL TEST COMPOSITION, DEVICE, METHOD FOR ITS PREPARATION AND METHOD FOR THE DETERMINATION OF PEROXIDATIVELY ACTIVE SUBSTANCE MILES INC. (US) 1990-06-27 EP claimed
US-4447542-A USING SUBSTITUTED CUMENE HYDROPEROXIDE AND INDICATOR; COLORIMETRIC ANALYSIS MILES LABORATORIES, INC. (US) 1984-05-08 US claimed
EP-0121192-B1 ANALYTICAL TEST COMPOSITION, DEVICE, METHOD FOR ITS PREPARATION AND METHOD FOR THE DETERMINATION OF PEROXIDATIVELY ACTIVE SUBSTANCE MILES INC. (US) 1990-06-27 EP disclosed
EP-0121192-A2 Analytical test composition, device, method for its preparation and method for the determination of peroxidatively active substance MILES INC. (US) 1984-10-10 EP disclosed
US-4447542-A USING SUBSTITUTED CUMENE HYDROPEROXIDE AND INDICATOR; COLORIMETRIC ANALYSIS MILES LABORATORIES, INC. (US) 1984-05-08 US disclosed