SCHEMBL4715974

SCHEMBL4715974

OCc1ccc(C23CNCC2C3)cc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.63
SLC6A4 P31645 8/20 0.63
SLC6A3 Q01959 8/20 0.63
KCNH2 Q12809 5/20 0.63
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
DRD3 P35462 3/20 0.51
DRD2 P14416 2/20 0.51

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
SCHEMBL4711836 0.83 SLC6A2 (0.68) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
Hydrochloric Acid SCHEMBL11625385 0.82 SLC6A2 (0.66) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
SCHEMBL4713090 0.81 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
SCHEMBL4759433 0.81 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
SCHEMBL11083508 0.81 SLC6A2 (0.59) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
SCHEMBL4712815 0.80 SLC6A2 (0.62) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
Hydrochloric Acid SCHEMBL11075765 0.79 SLC6A2 (0.67) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
Hydrochloric Acid SCHEMBL11077804 0.78 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
SCHEMBL4761203 0.77 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
SCHEMBL4712172 0.77 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1904059-A2 METHOD FOR TREATING NERVOUS SYSTEM DISORDERS AND CONDITIONS Wyeth a Corporation of the State of Delaware (US) 2008-04-02 EP claimed
WO-2007013936-A2 METHOD FOR TREATING NERVOUS SYSTEM DISORDERS AND CONDITIONS WYETH (US) 2007-02-01 WO claimed
US-20070021488-A1 Method for treating nervous system disorders and conditions WYETH (US) 2007-01-25 US claimed
US-4435419-A Method of treating depression using azabicyclohexanes AMERICAN CYANAMID COMPANY (US) 1984-03-06 US claimed
EP-1917242-B1 AZABICYCLO [3.1.0]HEXYLPHENYL DERIVATIVES AS MODULATORS OF DOPAMINE D3 RECEPTORS GLAXO GROUP LTD (GB) 2009-01-14 EP disclosed
EP-1904059-A2 METHOD FOR TREATING NERVOUS SYSTEM DISORDERS AND CONDITIONS Wyeth a Corporation of the State of Delaware (US) 2008-04-02 EP disclosed
WO-2007013936-A2 METHOD FOR TREATING NERVOUS SYSTEM DISORDERS AND CONDITIONS WYETH (US) 2007-02-01 WO disclosed
US-20070021488-A1 Method for treating nervous system disorders and conditions WYETH (US) 2007-01-25 US disclosed
US-4435419-A Method of treating depression using azabicyclohexanes AMERICAN CYANAMID COMPANY (US) 1984-03-06 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-20070021488-A1 Method for treating nervous system disorders and conditions AVPR1B, AVPR2, AVPR1A SLC6A2 33/4885SLC6A4 145/4885SLC6A3 100/4885

“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.