SCHEMBL17352131

SCHEMBL17352131

O=C(CCCCC(=O)Oc1ccc(F)c(C(F)(F)F)c1)Oc1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
CDK8 P49336 2/20 0.40
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
HTR2A P28223 1/20 0.39
SLC6A4 P31645 1/20 0.39
KCNH2 Q12809 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
PTPN7 P35236 1/20 0.38
DUSP3 P51452 1/20 0.38
EPHX1 P07099 1/20 0.36
AR P10275 1/20 0.36
KMO O15229 1/20 0.36

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
SCHEMBL17356332 0.98 KMT2A (0.44) KMT2ACDK8ALDH1A1HSD17B10HTR2A
SCHEMBL17356328 0.98 KMT2A (0.44) KMT2ACDK8ALDH1A1HSD17B10HTR2A
SCHEMBL17356326 0.97 KMT2A (0.41) KMT2ACDK8ALDH1A1HSD17B10HTR2A
SCHEMBL17352167 0.94 MAPT (0.44) KMT2ACDK8ALDH1A1HSD17B10HTR2A
SCHEMBL17355667 0.93 KMT2A (0.40) KMT2ACDK8ALDH1A1HSD17B10HTR2A
SCHEMBL17355666 0.92 KMT2A (0.39) KMT2ACDK8ALDH1A1HSD17B10HTR2A
SCHEMBL17356334 0.92 PPARG (0.45) KMT2ACDK8HTR2ASLC6A4KCNH2
SCHEMBL17355813 0.92 KMT2A (0.39) KMT2ACDK8ALDH1A1HSD17B10HTR2A
SCHEMBL17355669 0.92 KMT2A (0.39) KMT2ACDK8ALDH1A1HSD17B10HTR2A
SCHEMBL17355816 0.91 KMT2A (0.38) KMT2AALDH1A1HTR2ASLC6A4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 US disclosed
US-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 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 (1 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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE HCN2, SCO2, HCN1 KMT2A 2355/4885CDK8 4065/4885ALDH1A1 1059/4885

“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.