SCHEMBL12326552

SCHEMBL12326552

CCOC(=O)c1coc2c(F)c(F)c(F)cc2c1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.56
STAT3 P40763 1/20 0.47
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPT P10636 1/20 0.44
HSD17B10 Q99714 4/20 0.43
HPGD P15428 3/20 0.43
NPC1 O15118 2/20 0.43
MITF O75030 1/20 0.43
TP53 P04637 1/20 0.43
RECQL P46063 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
TBK1 Q9UHD2 1/20 0.41
GABRA1 P14867 1/20 0.40

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
SCHEMBL28759950 0.75 CYP4F2 (0.42) MAOBKMT2AKDM4EALDH1A1MAPT
SCHEMBL9838239 0.75 MAOB (0.48) MAOBKMT2AKDM4EALDH1A1MAPT
SCHEMBL29376920 0.74 CYP1A2 (0.66) STAT3KMT2AKDM4EALDH1A1MAPT
SCHEMBL9635290 0.74 CYP1A2 (0.66) STAT3KMT2AKDM4EALDH1A1MAPT
SCHEMBL2000865 0.72 CES2 (0.55) KMT2AKDM4EALDH1A1MAPTHSD17B10
SCHEMBL31264497 0.72 MAOB (0.49) MAOBKMT2AKDM4EHSD17B10HPGD
SCHEMBL18198420 0.72 MAOB (0.46) MAOBKMT2AKDM4EALDH1A1MAPT
SCHEMBL17321013 0.72 MAOB (0.44) MAOBKMT2AKDM4EALDH1A1MAPT
SCHEMBL26125713 0.72 MAOB (0.49) MAOBKMT2AKDM4EHSD17B10HPGD
SCHEMBL29895231 0.72 STAT3 (0.61) STAT3KMT2AKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436031-B2 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. (US) 2013-05-07 US disclosed
US-20110230523-A1 TRANSCRIPTION FACTOR MODULATING COMPOUNDS AND METHODS OF USE THEREOF PARATEK PHARMACEUTICALS, INC. (US) 2011-09-22 US disclosed
US-20090131401-A1 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. (US) 2009-05-21 US disclosed
US-20090131401-A1 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. (US) 2009-05-21 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-20090131401-A1 Transcription factor modulating compounds and methods of use thereof JUN, CREBBP, TFEB MAOB 3115/4885STAT3 13/4885KMT2A 806/4885
US-20110230523-A1 TRANSCRIPTION FACTOR MODULATING COMPOUNDS AND METHODS OF USE THEREOF JUN, CREBBP, TFEB MAOB 3115/4885STAT3 13/4885KMT2A 806/4885

“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.