SCHEMBL3197430

SCHEMBL3197430

CCOc1ncccc1OC(CC(C)C)C1CNCCO1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 13/20 0.50
SLC6A4 P31645 11/20 0.50
SLC6A3 Q01959 7/20 0.50
ADRB2 P07550 2/20 0.50
MLNR O43193 1/20 0.50
CHRM2 P08172 1/20 0.50
CHRM1 P11229 1/20 0.50
CHRM3 P20309 1/20 0.50
HTR2C P28335 1/20 0.50
OPRK1 P41145 1/20 0.50
KCNH2 Q12809 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
MAPK1 P28482 1/20 0.50
KMT2A Q03164 1/20 0.50
HTR1A P08908 1/20 0.43

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
SCHEMBL3194131 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3ADRB2MLNR
SCHEMBL3197539 0.90 SLC6A2 (0.53) SLC6A2SLC6A4SLC6A3ADRB2MLNR
SCHEMBL3187782 0.90 SLC6A2 (0.53) SLC6A2SLC6A4SLC6A3ADRB2MLNR
SCHEMBL3199913 0.88 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3ADRB2MLNR
SCHEMBL3183391 0.88 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3ADRB2MLNR
SCHEMBL3199714 0.87 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3ADRB2MLNR
SCHEMBL3197005 0.87 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3ADRB2MLNR
SCHEMBL3187638 0.87 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3ADRB2MLNR
SCHEMBL3183772 0.87 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3ADRB2MLNR
SCHEMBL3182888 0.86 SLC6A2 (0.67) SLC6A2SLC6A4SLC6A3ADRB2MLNR

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-7659394-B2 Substituted morpholine compounds for the treatment of central nervous system disorders PFIZER INC (US) 2010-02-09 US claimed
US-20050245519-A1 Substituted morpholine compounds for the treatment of central nervous system disorders WARNER-LAMBERT COMPANY LLC 2005-11-03 US claimed
US-7659394-B2 Substituted morpholine compounds for the treatment of central nervous system disorders PFIZER INC (US) 2010-02-09 US disclosed
US-20050245519-A1 Substituted morpholine compounds for the treatment of central nervous system disorders WARNER-LAMBERT COMPANY LLC 2005-11-03 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-20050245519-A1 Substituted morpholine compounds for the treatment of central nervous system disorders CNR1, OPRM1, HCRTR1 SLC6A2 124/4885SLC6A4 235/4885SLC6A3 93/4885

“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.