SCHEMBL1423799

SCHEMBL1423799

CC(C)c1ccccc1-c1ccc(OCc2ccc3ccccc3n2)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 2/20 0.59
CYSLTR2 Q9NS75 1/20 0.59
PDE10A Q9Y233 12/20 0.57
LGALS3 P17931 1/20 0.54
PDE4D Q08499 1/20 0.54

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
SCHEMBL1423657 0.83 PDE10A (0.72) CYSLTR1CYSLTR2PDE10ALGALS3PDE4D
SCHEMBL1424154 0.83 CYSLTR1 (0.57) CYSLTR1CYSLTR2PDE10ALGALS3PDE4D
SCHEMBL8647830 0.81 CYSLTR1 (0.52) CYSLTR1CYSLTR2PDE10A
SCHEMBL1423643 0.81 PDE10A (0.62) CYSLTR1CYSLTR2PDE10ALGALS3PDE4D
SCHEMBL1423762 0.81 CYSLTR1 (0.61) CYSLTR1CYSLTR2PDE10A
SCHEMBL1423674 0.81 PDE10A (0.71) CYSLTR1CYSLTR2PDE10ALGALS3PDE4D
SCHEMBL1423591 0.81 CYSLTR1 (0.67) CYSLTR1CYSLTR2PDE10A
SCHEMBL8647826 0.81 GPBAR1 (0.52) CYSLTR1CYSLTR2PDE10A
SCHEMBL1424251 0.79 CYSLTR1 (0.58) CYSLTR1CYSLTR2PDE10ALGALS3PDE4D
SCHEMBL13772898 0.79 CYSLTR1 (0.69) CYSLTR1CYSLTR2PDE10A

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-20110224204-A1 DI-SUBSTITUTED PHENYL COMPOUNDS ENVIVO PHARMACEUTICALS, INC. 2011-09-15 US disclosed
EP-2297131-A2 DI-SUBSTITUTED PHENYL COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS Envivo Pharmaceuticals, Inc. (US) 2011-03-23 EP disclosed
WO-2009158467-A2 DI-SUBSTITUTED PHENYL COMPOUNDS ENVIVO PHARMACEUTICALS, INC. (US) 2009-12-30 WO 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-20110224204-A1 DI-SUBSTITUTED PHENYL COMPOUNDS PDE10A, PDE1A, PDE12 CYSLTR1 4596/4885CYSLTR2 4646/4885PDE10A 1/4885

“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.