SCHEMBL18527239

SCHEMBL18527239

O=C(CC1CC1)c1cc(F)cc(F)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.51
HTR2A P28223 2/20 0.51
HTR2C P28335 2/20 0.51
HTR2B P41595 2/20 0.51
SIGMAR1 Q99720 2/20 0.51
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41

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
SCHEMBL17041598 0.91 PDE4A (0.51) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL31149614 0.85 CES2 (0.41) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL9631071 0.84 DRD2 (0.41) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL9631064 0.84 DRD2 (0.41) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL9631057 0.84 DRD2 (0.41) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL5469826 0.80 DRD2 (0.73) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL27707168 0.74 DRD2 (0.40) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL19367869 0.73 CES1 (0.59) CES2CES1
SCHEMBL8031381 0.73 KMT2A (0.44) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL6611458 0.73 DRD2 (0.65) DRD2HTR2AHTR2CHTR2BSIGMAR1

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
WO-2017031325-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF FORUM PHARMACEUTICALS INC. (US) 2017-02-23 WO disclosed
US-20170050980-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF DENALI THERAPEUTICS, INC. 2017-02-23 US disclosed
US-20170050980-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF DENALI THERAPEUTICS, INC. 2017-02-23 US disclosed
US-20170050980-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF DENALI THERAPEUTICS, INC. 2017-02-23 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-20170050980-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF PSEN2, SMN1; SMN2, OTC DRD2 661/4885HTR2A 189/4885HTR2C 215/4885

“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.