SCHEMBL550610

SCHEMBL550610

Cc1cc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.45
IDO1 P14902 2/20 0.41
ALDH1A1 P00352 3/20 0.40
ESR1 P03372 3/20 0.39
CYP3A4 P08684 2/20 0.39
ESR2 Q92731 2/20 0.39
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
S100B P04271 1/20 0.39
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
AR P10275 1/20 0.38
LTA4H P09960 1/20 0.38
TACR1 P25103 1/20 0.37
RAPGEF4 Q8WZA2 1/20 0.37

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
SCHEMBL10233280 0.91 SKP2 (0.41) SKP2IDO1ALDH1A1ESR1CYP3A4
SCHEMBL27912332 0.88 SKP2 (0.46) SKP2IDO1ALDH1A1ESR1CYP3A4
SCHEMBL552123 0.87 SKP2 (0.42) SKP2ALDH1A1ESR1CYP3A4ESR2
SCHEMBL551462 0.83 SKP2 (0.40) SKP2ALDH1A1ESR1CYP3A4ESR2
SCHEMBL28904169 0.82 IDO1 (0.46) IDO1ALDH1A1CYP3A4POLBTSHR
SCHEMBL237201 0.82 SKP2 (0.61) SKP2ALDH1A1ESR1CYP3A4ESR2
SCHEMBL31079561 0.82 SKP2 (0.61) SKP2ALDH1A1ESR1CYP3A4ESR2
SCHEMBL25516060 0.81 SKP2 (0.46) SKP2IDO1ALDH1A1ESR1CYP3A4
Hydrochloric Acid SCHEMBL8644397 0.80 SKP2 (0.59) SKP2ALDH1A1ESR1CYP3A4ESR2
SCHEMBL3482071 0.80 SKP2 (0.59) SKP2ALDH1A1ESR1CYP3A4ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110689-B2 Benzanilides with insecticidal activity BAYER CROPSCIENE AG (DE) 2012-02-07 US disclosed
US-8110689-B2 Benzanilides with insecticidal activity BAYER CROPSCIENE AG (DE) 2012-02-07 US disclosed
US-8110689-B2 Benzanilides with insecticidal activity BAYER CROPSCIENE AG (DE) 2012-02-07 US disclosed
US-20100062937-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY BAYER CROPSCIENCE AG (DE) 2010-03-11 US disclosed
US-20100062937-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY BAYER CROPSCIENCE AG (DE) 2010-03-11 US disclosed
US-20100062937-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY BAYER CROPSCIENCE AG (DE) 2010-03-11 US disclosed
EP-1893567-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY Bayer CropScience AG (DE) 2008-03-05 EP disclosed
WO-2006133823-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY BAYER CROPSCIENCE AG (DE) 2006-12-21 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-20100062937-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY CBR3, HCN3, HAX1 SKP2 4717/4885IDO1 1794/4885ALDH1A1 2102/4885

“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.