SCHEMBL15629779

SCHEMBL15629779

CCCC1CCCC1Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
PSEN1 P49768 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LTA4H P09960 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
DRD2 P14416 2/20 0.39
TP53 P04637 1/20 0.38
OPRM1 P35372 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38
FAAH O00519 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
SCHEMBL16560581 0.90 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3PSEN1L3MBTL1
SCHEMBL15627270 0.85 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3PSEN1L3MBTL1
SCHEMBL15611704 0.84 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3PSEN1L3MBTL1
SCHEMBL21180214 0.80 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3PSEN1L3MBTL1
SCHEMBL11310434 0.77 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL11310437 0.77 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL11310427 0.77 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL19308535 0.74 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3PSEN1L3MBTL1
SCHEMBL15627282 0.74 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3PSEN1L3MBTL1
SCHEMBL24168852 0.71 SLC6A2 (0.66) SLC6A2SLC6A4SLC6A3MEN1KMT2A

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-8916564-B2 Substituted pyrido[1,2-a]pyrazines for the treatment of neurodegenerative and neurological disorders PFIZER INC. (US) 2014-12-23 US disclosed
US-20140088111-A1 Novel Bicyclic Pyridinones PFIZER INC. (US) 2014-03-27 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-20140088111-A1 Novel Bicyclic Pyridinones CYP2B6, CYP2D6, CYP2C19 SLC6A2 683/4885SLC6A4 488/4885SLC6A3 1008/4885

“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.