SCHEMBL6236442

SCHEMBL6236442

C=C(c1ccc(N)c(C)c1)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 7/20 0.42
CYP3A4 P08684 7/20 0.42
ALDH1A1 P00352 3/20 0.42
TSHR P16473 3/20 0.42
S100B P04271 1/20 0.38
ESR1 P03372 2/20 0.38
AR P10275 1/20 0.38
ESR2 Q92731 1/20 0.38
MAPT P10636 4/20 0.36
THRB P10828 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
ALOX15 P16050 2/20 0.36
RECQL P46063 1/20 0.36
HIF1A Q16665 1/20 0.36
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
KDM4E B2RXH2 1/20 0.33
RAD52 P43351 1/20 0.33
SKP2 Q13309 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
SCHEMBL24222172 0.82 PRSS1 (0.45) TDP1ALDH1A1MAPTSMN1; SMN2PRSS1
SCHEMBL14962353 0.79 MAOA (0.40) PRSS1PRSS2PRSS3KDM4EPOLB
SCHEMBL3599141 0.79 ALDH1A1 (0.41) TDP1CYP3A4ALDH1A1TSHRSMN1; SMN2
SCHEMBL19306517 0.78 ACHE (0.46) TDP1CYP3A4ALDH1A1TSHRMAPT
SCHEMBL31394687 0.78 TSHR (0.42) TDP1CYP3A4ALDH1A1TSHRESR2
SCHEMBL27770756 0.78 TSHR (0.44) CYP3A4ALDH1A1TSHRMAPTSMN1; SMN2
SCHEMBL11010663 0.76 TDP1 (0.48) TDP1CYP3A4ALDH1A1TSHRS100B
SCHEMBL8282801 0.76 HDAC1 (0.49) ALDH1A1TSHRNPC1HTTTP53
SCHEMBL20934776 0.74 SLC6A2 (0.43) CYP3A4ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL3439094 0.74

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-20050250822-A1 Substituted benzanilide compound and noxious organism controlling agent NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-11-10 US disclosed
EP-1538138-A1 SUBSTITUTED BENZANILIDE COMPOUND AND PEST CONTROL AGENT NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 2005-06-08 EP 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-20050250822-A1 Substituted benzanilide compound and noxious organism controlling agent GCN1, L3MBTL3, L3MBTL4 TDP1 3916/4885CYP3A4 1864/4885ALDH1A1 1987/4885

“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.