SCHEMBL18313612

SCHEMBL18313612

CC(=O)c1cc2c(F)cccc2o1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
KDM4E B2RXH2 5/20 0.54
HSD17B10 Q99714 3/20 0.54
POLB P06746 3/20 0.54
MAPT P10636 3/20 0.54
KMT2A Q03164 3/20 0.54
GAA P10253 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
MEN1 O00255 2/20 0.54
ALOX12 P18054 1/20 0.54
KDM4C Q9H3R0 1/20 0.54
HPGD P15428 3/20 0.44
LMNA P02545 2/20 0.44
GLA P06280 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALB P02768 1/20 0.44
IL2 P60568 1/20 0.44
CASP1 P29466 1/20 0.44
BRCA1 P38398 1/20 0.44
CASP7 P55210 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
SCHEMBL29865935 0.84 CSNK2A1 (0.57) ALDH1A1KDM4EHSD17B10MAPTL3MBTL1
SCHEMBL27512420 0.84 CSNK2A1 (0.57) ALDH1A1KDM4EHSD17B10MAPTL3MBTL1
SCHEMBL7703619 0.84 ALB (0.44) ALDH1A1KDM4EHSD17B10POLBMAPT
SCHEMBL18313718 0.83 KDM4E (0.54) ALDH1A1KDM4EHSD17B10POLBMAPT
SCHEMBL20558990 0.82 KDM4E (0.48) ALDH1A1KDM4EHSD17B10MAPTKMT2A
SCHEMBL5584152 0.81 KDM4E (0.65) ALDH1A1KDM4EHSD17B10POLBMAPT
SCHEMBL21951007 0.79 KDM4E (0.54) ALDH1A1KDM4EHSD17B10POLBMAPT
SCHEMBL16708127 0.79 ALB (0.44) ALDH1A1KDM4EHSD17B10POLBMAPT
SCHEMBL16693136 0.79 MAOB (0.53) ALDH1A1KDM4EHSD17B10MAPTKMT2A
SCHEMBL31723089 0.78 ALB (0.41) ALDH1A1KDM4EHSD17B10POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9802927-B2 Oxadiazine compounds and methods of use thereof DENALI THERAPEUTICS, INC. (US) 2017-10-31 US disclosed
US-9802927-B2 Oxadiazine compounds and methods of use thereof DENALI THERAPEUTICS, INC. (US) 2017-10-31 US disclosed
US-9802927-B2 Oxadiazine compounds and methods of use thereof DENALI THERAPEUTICS, INC. (US) 2017-10-31 US disclosed
US-20170066753-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF DENALI THERAPEUTICS, INC. 2017-03-09 US disclosed
US-20170066753-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF DENALI THERAPEUTICS, INC. 2017-03-09 US disclosed
US-20170066753-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF DENALI THERAPEUTICS, INC. 2017-03-09 US disclosed
WO-2016201168-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF FORUM PHARMCEUTICALS INC. (US) 2016-12-15 WO 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-20170066753-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF PSEN2, SMN1; SMN2, OTC ALDH1A1 1137/4885KDM4E 3178/4885HSD17B10 602/4885

“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.