SCHEMBL16600153

SCHEMBL16600153

O=C(O)N1CCC(OCc2ccc(F)c(F)c2)CC1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 13/20 0.55
SIGMAR1 Q99720 12/20 0.55
TMEM97 Q5BJF2 4/20 0.55
DRD3 P35462 5/20 0.51
DRD5 P21918 1/20 0.49
MGLL Q99685 2/20 0.46
FAAH O00519 1/20 0.46
SCN9A Q15858 1/20 0.44
GRM2 Q14416 1/20 0.44
GRM3 Q14832 1/20 0.44
PREP P48147 1/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43

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
SCHEMBL2458433 0.92 DRD4 (0.51) DRD4SIGMAR1TMEM97DRD3DRD5
SCHEMBL16614220 0.86 DRD4 (0.53) DRD4SIGMAR1TMEM97DRD3DRD5
SCHEMBL4013732 0.85 CARM1 (0.54) MGLLFAAHGRIN2DGRIN3BGRIN1
SCHEMBL16614219 0.83 DRD4 (0.53) DRD4SIGMAR1TMEM97DRD3
SCHEMBL23365208 0.83 CARM1 (0.58) DRD4SIGMAR1TMEM97MGLLFAAH
SCHEMBL31381316 0.81 DRD4 (0.49) DRD4SIGMAR1TMEM97DRD3DRD5
SCHEMBL21409412 0.79 CARM1 (0.54) SIGMAR1TMEM97GRIN2DGRIN3BGRIN1
SCHEMBL23365206 0.79 CYP2C9 (0.52) SIGMAR1FAAH
SCHEMBL27629882 0.78 CARM1 (0.57) MGLLSCN9AGRM2GRM3GRIN2D
SCHEMBL20569837 0.78 MGLL (0.41) DRD4SIGMAR1TMEM97DRD3MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3049405-A1 AUTOTAXIN INHIBITOR COMPOUNDS Pharmakea Inc. (US) 2016-08-03 EP disclosed
US-20160214935-A1 AUTOTAXIN INHIBITOR COMPOUNDS DF 2024 IP ACQUISITION, LLC 2016-07-28 US disclosed
WO-2015048301-A1 AUTOTAXIN INHIBITOR COMPOUNDS PHARMAKEA, INC. (US) 2015-04-02 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-20160214935-A1 AUTOTAXIN INHIBITOR COMPOUNDS ENPP2, SERPINB1, SERPINE1 DRD4 4856/4885SIGMAR1 4804/4885TMEM97 4569/4885

“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.