SCHEMBL30330107

SCHEMBL30330107

Fc1ccc(C(N2CCNCC2)C(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 10/20 0.48
SLC6A4 P31645 8/20 0.48
KCNH2 Q12809 6/20 0.48
SLC6A3 Q01959 5/20 0.48
CYP2D6 P10635 4/20 0.48
TACR1 P25103 1/20 0.46
SIGMAR1 Q99720 1/20 0.44
CYP19A1 P11511 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KCNA5 P22460 1/20 0.40
P4HB P07237 1/20 0.39

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
SCHEMBL16121132 0.85 CYP2D6 (0.41) SLC6A2SLC6A4KCNH2SLC6A3CYP2D6
SCHEMBL14035305 0.84 MEN1 (0.59) SLC6A2SLC6A4KCNH2SLC6A3CYP2D6
SCHEMBL4095744 0.84 MEN1 (0.59) SLC6A2SLC6A4KCNH2SLC6A3CYP2D6
SCHEMBL14035482 0.84 MEN1 (0.59) SLC6A2SLC6A4KCNH2SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL23211984 0.83 MEN1 (0.58) SLC6A2SLC6A4KCNH2SLC6A3CYP2D6
SCHEMBL13723347 0.79 HRH3 (0.46) SLC6A2SLC6A4KCNH2SLC6A3CYP2D6
SCHEMBL13723937 0.79 HRH3 (0.46) SLC6A2SLC6A4KCNH2SLC6A3CYP2D6
SCHEMBL336219 0.78 CYP2D6 (0.67) SLC6A2SLC6A4KCNH2SLC6A3CYP2D6
SCHEMBL23212066 0.78 SLC6A2 (0.39) SLC6A2SLC6A4KCNH2SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL21381611 0.76 SLC6A2 (0.38) SLC6A2SLC6A4KCNH2SLC6A3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230117324-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2023-04-20 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-20230117324-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS MGLL, LPL, LIPC SLC6A2 4783/4885SLC6A4 4841/4885KCNH2 2806/4885

“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.