SCHEMBL15230620

SCHEMBL15230620

COC(=O)C1CC(c2nc(C(=O)OCc3c(F)cccc3Cl)cs2)CCN1C(=O)Cn1nc(C(F)(F)F)cc1C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.38
PPARG P37231 1/20 0.38
CCR1 P32246 2/20 0.37
CYP3A4 P08684 3/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
TPH1 P17752 2/20 0.35
TRPV1 Q8NER1 1/20 0.34
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
POLB P06746 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL15230828 0.88 GAA (0.38) GAAPPARGCCR1MEN1KMT2A
SCHEMBL1765165 0.88 CCR1 (0.44) GAAPPARGCCR1MEN1KMT2A
SCHEMBL15230212 0.86 CCR1 (0.41) GAACCR1MEN1KMT2ATRPV1
SCHEMBL15231257 0.85 PPARG (0.38) GAAPPARGCYP3A4MEN1KMT2A
SCHEMBL15230947 0.84 CCR1 (0.40) GAAPPARGCCR1MEN1KMT2A
SCHEMBL15231742 0.83 CCR1 (0.43) GAACCR1MEN1KMT2ATRPV1
SCHEMBL1765093 0.83 CCR1 (0.42) GAAPPARGCCR1TPH1ALDH1A1
SCHEMBL15230430 0.82 CCR1 (0.40) GAAPPARGCCR1MEN1KMT2A
SCHEMBL15230786 0.79 FAAH (0.42) GAA
SCHEMBL15231151 0.78 CCR1 (0.38) GAAPPARGCCR1MEN1KMT2A

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
US-20160007606-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2016-01-14 US disclosed
EP-2820012-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES Syngenta Participations AG (CH) 2015-01-07 EP disclosed
WO-2013127784-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2013-09-06 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-20160007606-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES PRF1, CASP1, MPO GAA 2269/4885PPARG 355/4885CCR1 110/4885

“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.