SCHEMBL7225260

SCHEMBL7225260

Fc1ccc(C2COCCN2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 1/20 0.44
PRKACG P22612 1/20 0.44
PRKACB P22694 1/20 0.44
ACVR1 Q04771 1/20 0.37
CSNK1D P48730 1/20 0.36
CSNK1E P49674 1/20 0.36
KCNH2 Q12809 1/20 0.36
KDM1A O60341 1/20 0.36
MAOB P27338 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
IDO1 P14902 2/20 0.34
TDO2 P48775 2/20 0.34
CTSK P43235 1/20 0.34
ATR Q13535 1/20 0.34
MAP4K1 Q92918 2/20 0.33
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32

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
SCHEMBL280628 0.81 CSNK1D (0.43) PRKACAPRKACGPRKACBACVR1CSNK1D
SCHEMBL18387 0.81 CSNK1D (0.43) PRKACAPRKACGPRKACBACVR1CSNK1D
SCHEMBL8321907 0.81 CSNK1D (0.43) PRKACAPRKACGPRKACBACVR1CSNK1D
Hydrochloric Acid SCHEMBL28500586 0.79 CSNK1D (0.43) PRKACAPRKACGPRKACBACVR1CSNK1D
Hydrochloric Acid SCHEMBL28214300 0.79 CSNK1D (0.43) PRKACAPRKACGPRKACBACVR1CSNK1D
SCHEMBL28785154 0.79 PRKACA (0.52) PRKACAPRKACGPRKACBCSNK1DCSNK1E
SCHEMBL432870 0.79 PRKACA (0.52) PRKACAPRKACGPRKACBCSNK1DCSNK1E
SCHEMBL30824548 0.79 PRKACA (0.52) PRKACAPRKACGPRKACBCSNK1DCSNK1E
SCHEMBL2944138 0.77 CHRNA7 (0.47) PRKACAPRKACGPRKACBCTSKSLC6A2
SCHEMBL22589151 0.77 CHRNA7 (0.47) PRKACAPRKACGPRKACBCTSKSLC6A2

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 PRKACA 3246/4885PRKACG 3542/4885PRKACB 3959/4885
US-20030212062-A1 Morpholinone and morpholine derivatives and uses thereof ADRA1D, ADRA1A, ADRB1 PRKACA 3246/4885PRKACG 3542/4885PRKACB 3959/4885

“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.