SCHEMBL7226013

SCHEMBL7226013

O=C1COCC(c2ccc(F)c(F)c2)N1C(=O)NCCCN1CCC(c2ccc(F)cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 18/20 0.66
ADRA1B P35368 17/20 0.66
ADRA1D P25100 16/20 0.66
HRH1 P35367 4/20 0.66
ADRA2A P08913 3/20 0.56
ADRA2B P18089 3/20 0.56
ADRA2C P18825 3/20 0.56
CCR2 P41597 2/20 0.45

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
SCHEMBL7233750 0.90 ADRA1A (0.56) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL7962803 0.86 ADRA1A (0.65) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL7962799 0.86 ADRA1A (0.65) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL7971478 0.86 ADRA1A (0.65) ADRA1AADRA1BADRA1DHRH1ADRA2A
Hydrochloric Acid SCHEMBL7963307 0.85 ADRA1A (0.64) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL7966169 0.84 ADRA1A (0.67) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL7226018 0.84 ADRA1A (0.80) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL7963294 0.84 ADRA1A (0.67) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL7960501 0.84 ADRA1A (0.65) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL7959815 0.84 ADRA1A (0.65) ADRA1AADRA1BADRA1DHRH1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212062-A1 Morpholinone and morpholine derivatives and uses thereof SYNAPTIC PHARMACEUTICAL CORPORATION 2003-11-13 US disclosed
US-6531471-B2 Antagonists for human alpha 1a receptors; lowering intraocular pressure; inhibiting cholesterol synthesis; relaxing lower urinary tract tissue; treatment of benign prostatic hyperplasia, impotency, cardiac arrhythmia, etc. SYNAPTIC PHARMACEUTICAL CORPORATION 2003-03-11 US disclosed
US-20020068737-A1 Morpholinone and morpholine derivatives and uses thereof SYNAPTIC PHARAMCEUTICAL CORPORATION 2002-06-06 US disclosed
US-6362182-B1 HYPOTENSIVE AGENTS; ANTICHOLESTEROL AGENTS; BENIGN PROSTATIC HYPERTROPIC SYNAPTIC PHARMACEUTICAL CORPORATION 2002-03-26 US disclosed
US-6218390-B1 FOR LOWERING INTRAOCULAR PRESSURE, INHIBITING CHOLESTEROL SYNTHESIS, RELAXING LOWER URINARY TRACT TISSUE, THERAPY OF BENIGN PROSTATIC HYPERPLASIA, IMPOTENCY, CARDIAC ARRHYTHMIA, SYMPATHETIC MEDIATED PAIN, MIGRAINE SYNAPTIC PHARMACEUTICAL CORPORATION 2001-04-17 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 (2 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-20020068737-A1 Morpholinone and morpholine derivatives and uses thereof ADRA1D, ADRA1A, ADRB1 ADRA1A 2/4885ADRA1B 7/4885ADRA1D 1/4885
US-20030212062-A1 Morpholinone and morpholine derivatives and uses thereof ADRA1D, ADRA1A, ADRB1 ADRA1A 2/4885ADRA1B 7/4885ADRA1D 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.