SCHEMBL7041206

SCHEMBL7041206

Cc1cccc(N2CCC(OS(C)(=O)=O)C2=O)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.46
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
MCHR1 Q99705 5/20 0.42
KMT2A Q03164 1/20 0.41
NOTUM Q6P988 1/20 0.41
ROCK2 O75116 1/20 0.41
CACNA1B Q00975 1/20 0.40
APBA1 Q02410 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL5827041 0.83 CA12 (0.53) MCHR1NOTUM
SCHEMBL8551967 0.82 MCHR1 (0.52) MCHR1NOTUMROCK2
SCHEMBL7609602 0.82 MCHR1 (0.52) MCHR1NOTUMROCK2
SCHEMBL7610270 0.82 MCHR1 (0.52) MCHR1NOTUMROCK2
SCHEMBL18740266 0.80 MCHR1 (0.47) MCHR1
SCHEMBL7806269 0.79 SLC6A2 (0.50) MCHR1
SCHEMBL25329652 0.78 MCHR1 (0.45) MCHR1
SCHEMBL12099243 0.77 HSD11B1 (0.52) HSD11B1MAOAMAOBKMT2ANOTUM
SCHEMBL18048545 0.77 ROCK2 (0.55) MCHR1ROCK2
SCHEMBL18048615 0.77 ROCK2 (0.55) MCHR1ROCK2

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-20030171218-A1 Substituted 3-heteroaryl(amino- or oxy)pyrrolidin-2-ones, their preparation and use as herbicides or plant growth regulators BAYER CROPSCIENCE GMBH (DE) 2003-09-11 US disclosed
WO-2003005824-A2 SUBSTITUTED 3-HETEROARYL (AMINO-OR-OXY)-PYRROLIDIN-2-ONES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS HERBICIDES OR AS PLANT GROWTH REGULATORS BAYER CROPSCIENCE GMBH (DE) 2003-01-23 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-20030171218-A1 Substituted 3-heteroaryl(amino- or oxy)pyrrolidin-2-ones, their preparation and use as herbicides or plant growth regulators DDT, OXGR1, OGDH HSD11B1 2424/4885MAOA 1275/4885MAOB 574/4885

“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.