SCHEMBL17238705

SCHEMBL17238705

FC(F)(F)c1c[c]c(C(F)(F)F)c(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.36
PDE2A O00408 3/20 0.35
ALDH1A1 P00352 5/20 0.34
HPGD P15428 2/20 0.33
GLA P06280 1/20 0.33
POLB P06746 3/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 3/20 0.31
HTT P42858 2/20 0.31
CYP3A4 P08684 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
GAA P10253 2/20 0.31
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
HIF1A Q16665 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
SCHEMBL15063962 0.82 ALDH1A1 (0.32) ALDH1A1
SCHEMBL2333762 0.80 PLAU (0.37) PLAUPDE2AALDH1A1HPGDGLA
SCHEMBL715069 0.78 PLAU (0.36) PLAUPDE2AALDH1A1HPGDGLA
SCHEMBL17238703 0.78
SCHEMBL630411 0.77 PLAU (0.35) PLAUPDE2AALDH1A1HPGDGLA
SCHEMBL19471036 0.77 NOTUM (0.35) PLAUPDE2AALDH1A1HPGDGLA
SCHEMBL454940 0.76 CES2 (0.35)
SCHEMBL17238695 0.74 PDE2A (0.36) PLAUPDE2AALDH1A1HPGDGLA
SCHEMBL16858738 0.72 KMT2A (0.35) PLAUPDE2AALDH1A1HPGDKDM4E
SCHEMBL1992298 0.72 GABRB3 (0.38) PLAUPDE2ASMN1; SMN2GABRA2GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10435374-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2019-10-08 US disclosed
US-20170305864-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2017-10-26 US disclosed
EP-2922831-B1 PESTICIDAL COMPOUNDS BASED ON ARYLTHIOSULFONAMIDE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-10-18 EP disclosed
US-9686988-B2 Pesticidal compounds based on arylthiosulfonamide derivatives SYNGENTA PARTICIPATIONS AG (CH) 2017-06-27 US disclosed
US-9675073-B2 Insecticidal compounds based on N-arylsulfanylmethylcarboxamidearylthiosulfonamides derivatives SYNGENTA PARTICIPATIONS AG (CH) 2017-06-13 US disclosed
US-20160286808-A1 PESTICIDAL COMPOUNDS BASED ON ARYLTHIOSULFONAMIDE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2016-10-06 US disclosed
US-20150320046-A1 INSECTICIDAL COMPOUNDS BASED ON N-ARYLSULFANYLMETHYLCARBOXAMIDEARYLTHIOSULFONAMIDES DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2015-11-12 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 (4 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-10435374-B2 Heterocyclic compounds as pesticides DDT, ACHE, PTMS PLAU 4408/4885PDE2A 712/4885ALDH1A1 2740/4885
US-20170305864-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES DDT, ACHE, PTMS PLAU 4408/4885PDE2A 712/4885ALDH1A1 2740/4885
US-20150320046-A1 INSECTICIDAL COMPOUNDS BASED ON N-ARYLSULFANYLMETHYLCARBOXAMIDEARYLTHIOSULFONAMIDES DERIVATIVES C1S, NISCH, ACHE PLAU 4809/4885PDE2A 750/4885ALDH1A1 564/4885
US-20160286808-A1 PESTICIDAL COMPOUNDS BASED ON ARYLTHIOSULFONAMIDE DERIVATIVES ACHE, CHRM2, DDT PLAU 4846/4885PDE2A 336/4885ALDH1A1 437/4885

“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.