SCHEMBL4334881

SCHEMBL4334881

CC(C)(O)CN[C@H]1CCOc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.46
SSTR4 P31391 1/20 0.42
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
CTSD P07339 3/20 0.37
BACE1 P56817 3/20 0.37
TRPV1 Q8NER1 4/20 0.37
BRD4 O60885 2/20 0.36
CREBBP Q92793 2/20 0.36
CCR2 P41597 1/20 0.36
DRD2 P14416 2/20 0.36
DRD3 P35462 2/20 0.36
ENPP2 Q13822 1/20 0.36
MAP3K14 Q99558 1/20 0.36

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
SCHEMBL4334884 1.00 HTR2A (0.46) HTR2ASSTR4CNR1CNR2CTSD
SCHEMBL5019354 0.80 HTR2A (0.50) HTR2ASSTR4CNR1CNR2TRPV1
SCHEMBL31595597 0.80 HTR2A (0.50) HTR2ASSTR4CNR1CNR2TRPV1
SCHEMBL22997177 0.74 PDPK1 (0.52) HTR2A
SCHEMBL29858433 0.74 PDPK1 (0.52) HTR2A
SCHEMBL7500388 0.74 PDPK1 (0.52) HTR2A
SCHEMBL130896 0.74 PDPK1 (0.52) HTR2A
SCHEMBL11666222 0.74 HTR2A (0.45) HTR2ABACE1ENPP2
SCHEMBL7857614 0.74 HTR2A (0.51) HTR2ASSTR4CNR1CNR2TRPV1
SCHEMBL7502205 0.73 HTR2A (0.51) HTR2ACNR1CNR2ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7618960-B2 Morpholine type cinnamide compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-11-17 US disclosed
EP-1953154-A1 MORPHOLINE TYPE CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2008-08-06 EP disclosed
US-20070117798-A1 Morpholine type cinnamide compound EISAI R&D MANAGEMENT CO., LTD. 2007-05-24 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-20070117798-A1 Morpholine type cinnamide compound MLX, XDH, NOX4 HTR2A 2030/4885SSTR4 1238/4885CNR1 16/4885

“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.