SCHEMBL4141986

SCHEMBL4141986

CNc1ccc(SC(F)(F)C(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.41
ALDH1A1 P00352 5/20 0.40
MAPT P10636 2/20 0.40
PTPN1 P18031 2/20 0.34
PTPRZ1 P23471 2/20 0.34
TSHR P16473 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 4/20 0.32
GAA P10253 2/20 0.32
POLB P06746 1/20 0.32
APP P05067 1/20 0.31
AR P10275 1/20 0.31
TP53 P04637 2/20 0.31
RECQL P46063 2/20 0.31
HSD17B10 Q99714 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CA12 O43570 1/20 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
SCHEMBL4164368 0.79 ALDH1A1 (0.52) KIF11ALDH1A1MAPTPTPN1PTPRZ1
SCHEMBL4158524 0.74 LMNA (0.32) TSHRLMNAHSD17B10SMN1; SMN2ALOX15
SCHEMBL4157937 0.74 ESR1 (0.34) TSHRLMNAHSD17B10SMN1; SMN2HPGD
SCHEMBL10361212 0.74 ALDH1A1 (0.61) KIF11ALDH1A1MAPTPTPN1PTPRZ1
SCHEMBL19356939 0.74 NR1H2 (0.42) KIF11ALDH1A1MAPTPTPN1PTPRZ1
SCHEMBL4150588 0.73 PTGS2 (0.31) TSHRHSD17B10ALOX15
SCHEMBL10978406 0.73 SMN1; SMN2 (0.38) KIF11ALDH1A1MAPTPTPN1PTPRZ1
SCHEMBL10505117 0.72 KIF11 (0.43) KIF11ALDH1A1MAPTTSHRTRPV1
SCHEMBL7491009 0.71 KIF11 (0.43) KIF11ALDH1A1MAPTPTPN1PTPRZ1
SCHEMBL5687891 0.69 KDM4E (0.31) ALDH1A1KDM4ETDP1

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-20090176786-A1 Benzoylurea Compounds and Use Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-07-09 US disclosed
US-20090176786-A1 Benzoylurea Compounds and Use Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-07-09 US disclosed
WO-2007046513-A2 BENZOYLUREA COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-26 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-20090176786-A1 Benzoylurea Compounds and Use Thereof BTK, BRIX1, NFXL1 KIF11 3287/4885ALDH1A1 1454/4885MAPT 4585/4885

“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.