SCHEMBL2896498

SCHEMBL2896498

O=c1oc2cc(OC3CC4CCC(C3)N4)ccc2s1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 15/20 0.54
SLC6A2 P23975 12/20 0.54
SLC6A3 Q01959 12/20 0.54
MAOA P21397 5/20 0.45
MAOB P27338 5/20 0.45
CA2 P00918 1/20 0.42
ALPI P09923 1/20 0.42
MAPT P10636 1/20 0.42
ALPG P10696 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL2896496 1.00 SLC6A4 (0.54) SLC6A4SLC6A2SLC6A3MAOAMAOB
SCHEMBL3650291 0.77 MAOB (0.44) MAOAMAOBCA2ALPIMAPT
SCHEMBL2895085 0.76 SLC6A4 (0.56) SLC6A4SLC6A2SLC6A3
SCHEMBL2895090 0.76 SLC6A4 (0.56) SLC6A4SLC6A2SLC6A3
SCHEMBL2895084 0.76 SLC6A4 (0.56) SLC6A4SLC6A2SLC6A3
Ip-2018 SCHEMBL25368803 0.76 SLC6A4 (0.59) SLC6A4SLC6A2SLC6A3MAOAHPGD
SCHEMBL2888566 0.72 SLC6A4 (0.55) SLC6A4SLC6A2SLC6A3MAOAMAOB
SCHEMBL15304588 0.72 SLC6A4 (0.82) SLC6A4SLC6A2SLC6A3MAOAMAOB
SCHEMBL742602 0.72 SLC6A4 (0.82) SLC6A4SLC6A2SLC6A3MAOAMAOB
SCHEMBL2888569 0.72 SLC6A4 (0.55) SLC6A4SLC6A2SLC6A3MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100286195-A1 NOVEL BENZOOXAZOL-AND BENZOOXATHIOL-2-ONE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2010-11-11 US claimed
US-20100286195-A1 NOVEL BENZOOXAZOL-AND BENZOOXATHIOL-2-ONE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2010-11-11 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-20100286195-A1 NOVEL BENZOOXAZOL-AND BENZOOXATHIOL-2-ONE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS SLC18A2, MAOB, SLC6A2 SLC6A4 11/4885SLC6A2 3/4885SLC6A3 7/4885

“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.