SCHEMBL552123

SCHEMBL552123

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.42
ESR1 P03372 3/20 0.40
ESR2 Q92731 2/20 0.40
AR P10275 1/20 0.40
ALDH1A1 P00352 7/20 0.38
GAA P10253 3/20 0.37
CYP3A4 P08684 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
S100B P04271 1/20 0.37
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALOX15 P16050 2/20 0.33
HSD17B10 Q99714 2/20 0.33
HPGD P15428 1/20 0.33
CDC25B P30305 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
SCHEMBL551462 0.90 SKP2 (0.40) SKP2ESR1ESR2ARALDH1A1
SCHEMBL550610 0.87 SKP2 (0.45) SKP2ESR1ESR2ARALDH1A1
SCHEMBL551595 0.81 SKP2 (0.42) SKP2ESR1ESR2ARALDH1A1
SCHEMBL31079561 0.79 SKP2 (0.61) SKP2ESR1ESR2ARALDH1A1
SCHEMBL237201 0.79 SKP2 (0.61) SKP2ESR1ESR2ARALDH1A1
SCHEMBL10233280 0.79 SKP2 (0.41) SKP2ESR1ESR2ARALDH1A1
SCHEMBL27912332 0.79 SKP2 (0.46) SKP2ESR1ESR2ARALDH1A1
SCHEMBL3377615 0.77 CYP3A4 (0.48) SKP2ESR1ESR2ARALDH1A1
Hydrochloric Acid SCHEMBL8644397 0.77 SKP2 (0.59) SKP2ESR1ESR2ARALDH1A1
Ammonia Solution, Strong SCHEMBL22344976 0.77 SKP2 (0.59) SKP2ESR1ESR2ARALDH1A1

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 2 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-20100062937-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY BAYER CROPSCIENCE AG (DE) 2010-03-11 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-20100062937-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY CBR3, HCN3, HAX1 SKP2 4717/4885ESR1 4743/4885ESR2 4710/4885

“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.