SCHEMBL4158319

SCHEMBL4158319

Nc1c(F)cc(SC(F)(F)F)cc1F

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
KCNH2 Q12809 1/20 0.37
LMNA P02545 2/20 0.35
HTT P42858 2/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
HTR2A P28223 2/20 0.34
PTPRZ1 P23471 2/20 0.33
PTPN1 P18031 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
KIF11 P52732 1/20 0.31
PDE2A O00408 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3627129 0.76 ALDH1A1 (0.54) KDM4EALDH1A1TDP1KCNH2LMNA
SCHEMBL2000463 0.74 ALDH1A1 (0.46) KDM4EALDH1A1TDP1KCNH2LMNA
SCHEMBL998647 0.74 KDM4E (0.46) KDM4EALDH1A1TDP1KCNH2LMNA
SCHEMBL7751960 0.74 ALDH1A1 (0.42) KDM4EALDH1A1TDP1KCNH2LMNA
SCHEMBL941267 0.74 HDAC1 (0.38) ALDH1A1HDAC1HDAC6
SCHEMBL5982122 0.74 HDAC1 (0.38) ALDH1A1MAPTTSHRMAPK1HDAC1
SCHEMBL30868412 0.73 KDM4E (0.41) KDM4EALDH1A1TDP1KCNH2LMNA
SCHEMBL20411965 0.72 KDM4E (0.42) KDM4EALDH1A1TDP1KCNH2LMNA
SCHEMBL4149992 0.71 KDM4E (0.34) KDM4EALDH1A1TDP1PTPRZ1PTPN1
SCHEMBL12691796 0.69 PDE2A (0.36) KDM4EALDH1A1TDP1HTR2APDE2A

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 4 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
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 KDM4E 1105/4885ALDH1A1 1454/4885TDP1 1690/4885

“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.