SCHEMBL1359660

SCHEMBL1359660

Nc1cccc(SC(F)(F)C(F)(F)C(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.42
MAPK1 P28482 2/20 0.42
CYP3A4 P08684 2/20 0.39
CASP1 P29466 1/20 0.39
RECQL P46063 1/20 0.39
ALDH1A1 P00352 7/20 0.35
TDP1 Q9NUW8 3/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 3/20 0.34
THRB P10828 1/20 0.34
KMT2A Q03164 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
HSD17B10 Q99714 1/20 0.32
MAOA P21397 1/20 0.32
PDE7A Q13946 2/20 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
SCHEMBL25118322 0.81 TSHR (0.42) TSHRMAPK1CYP3A4CASP1RECQL
SCHEMBL656796 0.80 ALDH1A1 (0.56) TSHRMAPK1CYP3A4CASP1RECQL
SCHEMBL29574292 0.80 ALDH1A1 (0.56) TSHRMAPK1CYP3A4CASP1RECQL
SCHEMBL698212 0.76 ALDH1A1 (0.61) TSHRMAPK1CYP3A4ALDH1A1TDP1
SCHEMBL776220 0.76 ALDH1A1 (0.46) TSHRMAPK1ALDH1A1TDP1KDM4E
SCHEMBL4145466 0.73 ALDH1A1 (0.41) TSHRMAPK1ALDH1A1TDP1KDM4E
SCHEMBL5313141 0.72 CYP3A4 (0.46) TSHRMAPK1CYP3A4CASP1RECQL
SCHEMBL12003617 0.71 ALDH1A1 (0.39) TSHRMAPK1CYP3A4RECQLALDH1A1
SCHEMBL698093 0.71 LMNA (0.35) TSHRMAPK1ALDH1A1TDP1KDM4E
Hydrochloric Acid SCHEMBL27555401 0.71 HSD17B10 (0.44) TSHRMAPK1CYP3A4CASP1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067638-B2 Amide derivative and insecticide containing the same MITSUI CHEMICALS, INC. (JP) 2011-11-29 US disclosed
US-20090233962-A1 Amide derivative and insecticide containing the same MITSUI CHEMICALS, INC. (JP) 2009-09-17 US disclosed
EP-1911751-A1 AMIDE DERIVATIVE AND PESTICIDE CONTAINING SUCH COMPOUND Mitsui Chemicals, Inc. (JP) 2008-04-16 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-20090233962-A1 Amide derivative and insecticide containing the same CYP1A1, CYP4B1, CYP2E1 TSHR 1212/4885MAPK1 2167/4885CYP3A4 10/4885

“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.