SCHEMBL3197096

SCHEMBL3197096

CC(C)(C)OC(=O)N1CCOC(C(Oc2ccccc2CO)c2ccccc2)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 10/20 0.41
SLC6A4 P31645 9/20 0.41
GPR119 Q8TDV5 3/20 0.39
KDM4E B2RXH2 2/20 0.38
PKM P14618 1/20 0.38
USP30 Q70CQ3 1/20 0.38
SLC6A3 Q01959 5/20 0.38
MLNR O43193 1/20 0.38
ADRB2 P07550 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2C P28335 1/20 0.38
OPRK1 P41145 1/20 0.38
KCNH2 Q12809 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 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
SCHEMBL13483155 1.00 SLC6A2 (0.41) SLC6A2SLC6A4GPR119KDM4EPKM
SCHEMBL13482009 1.00 SLC6A2 (0.41) SLC6A2SLC6A4GPR119KDM4EPKM
SCHEMBL5199205 0.96 SLC6A2 (0.39) SLC6A2SLC6A4GPR119KDM4EPKM
SCHEMBL13483157 0.93 SLC6A2 (0.41) SLC6A2SLC6A4GPR119KDM4EPKM
SCHEMBL3194282 0.93 SLC6A2 (0.41) SLC6A2SLC6A4GPR119KDM4EPKM
SCHEMBL13482013 0.93 SLC6A2 (0.41) SLC6A2SLC6A4GPR119KDM4EPKM
SCHEMBL5298242 0.87 SLC6A2 (0.41) SLC6A2SLC6A4GPR119KDM4EPKM
SCHEMBL5298248 0.87 SLC6A2 (0.41) SLC6A2SLC6A4GPR119KDM4EPKM
SCHEMBL5298240 0.87 SLC6A2 (0.41) SLC6A2SLC6A4GPR119KDM4EPKM
SCHEMBL5297887 0.87 SLC6A2 (0.53) SLC6A2SLC6A4GPR119KDM4EUSP30

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 disclosed
EP-1745029-A1 SUBSTITUTED MORPHOLINE COMPOUNDS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS Warner-Lambert Company LLC (US) 2007-01-24 EP disclosed
WO-2005105763-A1 SUBSTITUTED MORPHOLINE COMPOUNDS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS WARNER-LAMBERT COMPANY LLC (US) 2005-11-10 WO 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 235/4885GPR119 392/4885

“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.