SCHEMBL1949189

SCHEMBL1949189

O=c1oc2cc(OC3CC4CCCC(C3)N4)ccc2cc1-c1ccco1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.49
SLC6A3 Q01959 11/20 0.49
SLC6A4 P31645 11/20 0.49
MAOB P27338 4/20 0.43
MAOA P21397 2/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
Hydrochloric Acid SCHEMBL1950394 0.99 SLC6A2 (0.48) SLC6A2SLC6A3SLC6A4MAOBMAOA
SCHEMBL3185506 0.96 SLC6A4 (0.53) SLC6A2SLC6A3SLC6A4MAOB
SCHEMBL3185502 0.96 SLC6A4 (0.53) SLC6A2SLC6A3SLC6A4MAOB
SCHEMBL3206669 0.82 SLC6A4 (0.56) SLC6A2SLC6A3SLC6A4MAOBMAOA
SCHEMBL3396461 0.80 NPC1 (0.58) SLC6A2SLC6A3SLC6A4MAOBNPC1
SCHEMBL3396463 0.80 NPC1 (0.58) SLC6A2SLC6A3SLC6A4MAOBNPC1
SCHEMBL1951924 0.80 SLC6A4 (0.56) SLC6A2SLC6A3SLC6A4MAOBMAOA
Hydrochloric Acid SCHEMBL1951921 0.79 SLC6A4 (0.55) SLC6A2SLC6A3SLC6A4MAOBMAOA
SCHEMBL1949772 0.78 MAOB (0.40) MAOBMAOANPC1RAB9A
SCHEMBL1949774 0.78 MAOB (0.40) MAOBMAOANPC1RAB9A

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
US-20110136854-A1 NOVEL 9-AZA-BICYCLO[3.3.1]NON-3-YLOXY CHROMEN-2-ONE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2011-06-09 US claimed
US-20110136854-A1 NOVEL 9-AZA-BICYCLO[3.3.1]NON-3-YLOXY CHROMEN-2-ONE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2011-06-09 US disclosed
EP-2242754-A1 NOVEL 9-AZA-BICYCLO[3.3.1]NON-3-YLOXY CHROMEN-2-ONE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NeuroSearch A/S (DK) 2010-10-27 EP disclosed
WO-2009098209-A1 NOVEL 9-AZA-BICYCLO[3.3.1]NON-3-YLOXY CHROMEN-2-ONE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2009-08-13 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-20110136854-A1 NOVEL 9-AZA-BICYCLO[3.3.1]NON-3-YLOXY CHROMEN-2-ONE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS SLC18A2, SLC6A2, SLC18A3 SLC6A2 2/4885SLC6A3 7/4885SLC6A4 6/4885

“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.