SCHEMBL4076283

SCHEMBL4076283

Br[Zn]Cc1ccccc1Oc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.56
SLC6A4 P31645 9/20 0.55
SLC6A2 P23975 6/20 0.55
RIPK1 Q13546 1/20 0.55
CYP19A1 P11511 1/20 0.45
SLC6A3 Q01959 5/20 0.45
HTR2A P28223 4/20 0.42
LTA4H P09960 1/20 0.42
TSHR P16473 1/20 0.42
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
FFAR1 O14842 1/20 0.41
MAOA P21397 1/20 0.41
DPP4 P27487 1/20 0.41
P2RX3 P56373 1/20 0.40
PPARA Q07869 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
SCHEMBL30054133 0.79 HRH1 (0.60) HRH1SLC6A4SLC6A2RIPK1CYP19A1
SCHEMBL561362 0.79 HRH1 (0.60) HRH1SLC6A4SLC6A2RIPK1CYP19A1
SCHEMBL3334897 0.79 HRH1 (0.64) HRH1SLC6A4SLC6A2RIPK1CYP19A1
SCHEMBL313132 0.77 HRH1 (0.62) HRH1SLC6A4SLC6A2RIPK1CYP19A1
SCHEMBL16111413 0.76 HRH1 (0.67) HRH1SLC6A4SLC6A2RIPK1CYP19A1
SCHEMBL3142433 0.75 HRH1 (0.60) HRH1SLC6A4SLC6A2RIPK1CYP19A1
SCHEMBL194417 0.75 HRH1 (0.60) HRH1SLC6A4SLC6A2RIPK1CYP19A1
SCHEMBL327806 0.75 SLC6A4 (0.63) HRH1SLC6A4SLC6A2RIPK1CYP19A1
SCHEMBL1196716 0.75 HRH1 (0.71) HRH1SLC6A4SLC6A2RIPK1CYP19A1
SCHEMBL2031145 0.75 HRH1 (0.60) HRH1SLC6A4SLC6A2RIPK1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595315-B2 Morpholine derivatives as norepinephrine reuptake inhibitors ELI LILLY AND COMPANY (US) 2009-09-29 US disclosed
EP-1716126-B1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS LILLY CO ELI (US) 2009-02-25 EP disclosed
US-20070060585-A1 Morpholine derivatives as norepinephrine reuptake inhibitors ELI LILLY AND COMPANY 2007-03-15 US disclosed
EP-1716126-A1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2006-11-02 EP disclosed
WO-2005066144-A1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2005-07-21 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-20070060585-A1 Morpholine derivatives as norepinephrine reuptake inhibitors SLC6A2, SLC18A2, SLC6A3 HRH1 556/4885SLC6A4 4/4885SLC6A2 1/4885

“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.