SCHEMBL7927757

SCHEMBL7927757

O=C(O)/C(Cl)=C/c1cc(-n2c(=O)cc(C(F)(F)F)[nH]c2=O)ccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 13/20 0.42
BCAT2 O15382 11/20 0.42
SMN1; SMN2 Q16637 4/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TSHR P16473 1/20 0.34
NOTUM Q6P988 1/20 0.33
TNF P01375 1/20 0.32
LMNA P02545 1/20 0.32
HSPA1A P0DMV8 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NOD1 Q9Y239 1/20 0.32

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
SCHEMBL7927759 1.00 BCAT1 (0.42) BCAT1BCAT2SMN1; SMN2ALDH1A1CYP2C9
SCHEMBL7930378 0.85 BCAT1 (0.42) BCAT1BCAT2SMN1; SMN2ALDH1A1TSHR
SCHEMBL7930382 0.85 BCAT1 (0.42) BCAT1BCAT2SMN1; SMN2ALDH1A1TSHR
SCHEMBL9274567 0.79 TDP1 (0.50) BCAT1BCAT2SMN1; SMN2ALDH1A1CYP2C9
SCHEMBL7930437 0.77 NOTUM (0.35) ALDH1A1NOTUMHTT
SCHEMBL7930440 0.77 NOTUM (0.35) ALDH1A1NOTUMHTT
SCHEMBL8105838 0.76 BCAT1 (0.49) BCAT1BCAT2SMN1; SMN2ALDH1A1CYP2C9
SCHEMBL8105836 0.76 BCAT1 (0.49) BCAT1BCAT2SMN1; SMN2ALDH1A1CYP2C9
SCHEMBL9423250 0.76 BCAT1 (0.48) BCAT1BCAT2SMN1; SMN2ALDH1A1CYP2C9
SCHEMBL10419155 0.76 BCAT1 (0.42) BCAT1BCAT2SMN1; SMN2ALDH1A1TNF

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-20010031865-A1 Substituted 3-phenyluracils KLINTZ RALF (DE) 2001-10-18 US disclosed
US-6239074-B1 HERBICIDES, INSECTICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-05-29 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-20010031865-A1 Substituted 3-phenyluracils CCR1, CCR6, CCR3 BCAT1 139/4885BCAT2 599/4885SMN1; SMN2 4165/4885

“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.