SCHEMBL12690366

SCHEMBL12690366

CCOC(=O)Oc1c(F)c(F)c(C)c(F)c1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
SOAT1 P35610 1/20 0.44
RAB9A P51151 2/20 0.39
MTOR P42345 1/20 0.39
TAS1R3 Q7RTX0 2/20 0.38
TAS1R1 Q7RTX1 2/20 0.38
TAS1R2 Q8TE23 2/20 0.38
CUL4A Q13619 1/20 0.36
LMNA P02545 3/20 0.36
HSD17B10 Q99714 2/20 0.36
GAA P10253 2/20 0.35
ALOX15 P16050 2/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
KMT2A Q03164 3/20 0.33
MAPT P10636 3/20 0.33
KDM4E B2RXH2 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33

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
SCHEMBL1401567 0.91 ALDH1A1 (0.52) ALDH1A1SOAT1RAB9AMTORCUL4A
SCHEMBL847735 0.82 TAS1R3 (0.38) TAS1R3TAS1R1TAS1R2RECQL
SCHEMBL16982882 0.80 TAS1R3 (0.37) TAS1R3TAS1R1TAS1R2
SCHEMBL16838219 0.78 TAS1R3 (0.44) TAS1R3TAS1R1TAS1R2HSD17B10KMT2A
SCHEMBL19543199 0.77 KMT2A (0.37) ALDH1A1TAS1R3TAS1R1TAS1R2LMNA
SCHEMBL8567975 0.76 ALDH1A1 (0.36) ALDH1A1SOAT1RAB9AMTORCUL4A
SCHEMBL19543215 0.75 ALDH1A1 (0.43) ALDH1A1SOAT1CUL4ALMNAKMT2A
SCHEMBL1787407 0.75 ALDH1A1 (0.43) ALDH1A1SOAT1RAB9ACUL4ALMNA
SCHEMBL10261302 0.73 KDM4E (0.38) ALDH1A1TAS1R3TAS1R1TAS1R2LMNA
SCHEMBL17972598 0.72 MEN1 (0.30) KMT2AMEN1

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
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2017-11-02 US disclosed
US-8410290-B2 Cyclic carbonyl compounds with pendant carbonate groups, preparations thereof, and polymers therefrom INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-04-02 US disclosed
US-8389746-B2 Cyclic carbonyl compounds with pendant carbonate groups, preparations thereof, and polymers therefrom INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-03-05 US disclosed
US-20120252983-A1 CYCLIC CARBONYL COMPOUNDS WITH PENDANT CARBONATE GROUPS, PREPARATIONS THEREOF, AND POLYMERS THEREFROM CENTRAL GLASS CO., LTD. (JP) 2012-10-04 US disclosed
US-20120245304-A1 CYCLIC CARBONYL COMPOUNDS WITH PENDANT CARBONATE GROUPS, PREPARATIONS THEREOF, AND POLYMERS THEREFROM CENTRAL GLASS CO., LTD. (JP) 2012-09-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120252983-A1 CYCLIC CARBONYL COMPOUNDS WITH PENDANT CARBONATE GROUPS, PREPARATIONS THEREOF, AND POLYMERS THEREFROM NOTUM, PFAS, PCNA ALDH1A1 1287/4885SOAT1 1245/4885RAB9A 3376/4885
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR HDGF, F11, F12 ALDH1A1 1582/4885SOAT1 225/4885RAB9A 3753/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.