SCHEMBL466150

SCHEMBL466150

CCc1ccc(-c2ccc(Cl)cc2F)cc1/C1=C(\O)C[C@H]2CC[C@H](CC2)[C@H](C)C1=O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HPD P32754 1/20 0.31
CCR2 P41597 2/20 0.31
CXCR3 P49682 2/20 0.31
CCR1 P32246 1/20 0.31
CCR5 P51681 1/20 0.31
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL10244005 0.88 ACACB (0.34)
SCHEMBL468920 0.87 HPD (0.33) HPDCXCR3CYP11B1CYP11B2
SCHEMBL468817 0.87 ACACB (0.37) CYP11B1CYP11B2
SCHEMBL10245073 0.80 CNR2 (0.32)
SCHEMBL468863 0.80 PDK1 (0.33)
SCHEMBL430119 0.79 KLKB1 (0.34) CCR2CCR1CCR5CYP11B1CYP11B2
SCHEMBL431241 0.78 CALML3 (0.32) CCR2CXCR3CCR1CCR5CYP11B1
SCHEMBL13284322 0.77 FASN (0.35) HPDCCR2CCR1CCR5CYP11B1
SCHEMBL12116000 0.77 FASN (0.35) HPDCCR2CCR1CCR5CYP11B1
SCHEMBL10245513 0.77 EDNRB (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065066-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-03-15 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 (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 HPD 46/4885CCR2 2351/4885CXCR3 3560/4885

“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.