SCHEMBL447609

SCHEMBL447609

CCc1ccc(-c2ccc(Cl)cc2)cc1C1C(=O)[C@H]2[C@@H]3CC[C@@H](C(=O)C3)[C@H]2C1=O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.31

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
SCHEMBL452406 0.89 TAAR1 (0.36) TAAR1
SCHEMBL452407 0.89 TAAR1 (0.36) TAAR1
SCHEMBL449377 0.86 TAAR1 (0.34) TAAR1
SCHEMBL449376 0.86 TAAR1 (0.34) TAAR1
SCHEMBL447027 0.85 MAPT (0.31)
SCHEMBL447028 0.85 MAPT (0.31)
SCHEMBL447253 0.82 SMN1; SMN2 (0.39) TAAR1
SCHEMBL452188 0.79 TDP2 (0.35) TAAR1
SCHEMBL452189 0.79 TDP2 (0.35) TAAR1
SCHEMBL451891 0.75 KLKB1 (0.36) TAAR1

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
EP-2429979-A1 NOVEL HERBICIDES Syngenta Limited (GB) 2012-03-21 EP disclosed
US-20120065066-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-03-15 US disclosed
WO-2010133232-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-11-25 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-20120065066-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 TAAR1 1046/4885

“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.