SCHEMBL3224798

SCHEMBL3224798

Cc1cc(C(F)(C(F)(F)F)C(F)(F)F)cc(C)c1NC(=O)c1cc(F)c(F)c([N+](=O)[O-])c1F

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.37
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 5/20 0.33
P2RX1 P51575 2/20 0.33
RAB9A P51151 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
KCNMA1 Q12791 1/20 0.33
LMNA P02545 3/20 0.33
HTT P42858 2/20 0.33
NPC1 O15118 2/20 0.33
DHODH Q02127 1/20 0.33
TSHR P16473 1/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 1/20 0.32
TMPRSS4 Q9NRS4 1/20 0.32

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
SCHEMBL3201600 0.87 MEN1 (0.35) RORCMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL3216773 0.81 CYP1A2 (0.37) MEN1KMT2AMAPTSMN1; SMN2P2RX1
SCHEMBL1844350 0.79 KCNMA1 (0.51) RORCMEN1KMT2ASMN1; SMN2P2RX1
SCHEMBL3220394 0.79 RORC (0.53) RORCMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL13455946 0.78 CYP1A2 (0.34) MEN1KMT2AMAPTSMN1; SMN2P2RX1
SCHEMBL13490723 0.77 SMN1; SMN2 (0.39) RORCMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL1275444 0.77 KCNMA1 (0.45) RORCMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL3211887 0.74 IRAK4 (0.49) MEN1KMT2AMAPTSMN1; SMN2RAB9A
SCHEMBL27785087 0.74 MEN1 (0.50) MEN1KMT2AMAPTSMN1; SMN2RAB9A
SCHEMBL1847012 0.73 DHODH (0.51) RORCMEN1KMT2AP2RX1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2120556-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-03-09 EP disclosed
EP-2120556-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-03-09 EP disclosed
US-8389766-B2 Insecticidal compounds SYNGENTA CROP PROTECTION LLC (US) 2013-03-05 US disclosed
US-8389766-B2 Insecticidal compounds SYNGENTA CROP PROTECTION LLC (US) 2013-03-05 US disclosed
US-8389766-B2 Insecticidal compounds SYNGENTA CROP PROTECTION LLC (US) 2013-03-05 US disclosed
US-20100056639-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-03-04 US disclosed
US-20100056639-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-03-04 US disclosed
US-20100056639-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-03-04 US disclosed
EP-2120556-A1 INSECTICIDAL COMPOUNDS Syngeta Participations AG (CH) 2009-11-25 EP disclosed
WO-2008074427-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2008-06-26 WO disclosed
WO-2008074427-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2008-06-26 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-20100056639-A1 INSECTICIDAL COMPOUNDS ACHE, CHRM1, NIT2 RORC 4744/4885MEN1 860/4885KMT2A 2178/4885

“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.