SCHEMBL7674146

SCHEMBL7674146

CC(N)CNC(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.64
ALDH1A1 P00352 1/20 0.64
NPSR1 Q6W5P4 1/20 0.63
NPC1 O15118 1/20 0.59
GPR139 Q6DWJ6 1/20 0.58
TP53 P04637 1/20 0.57
TP53BP1 Q12888 1/20 0.57
TAS1R3 Q7RTX0 1/20 0.56
TAS1R1 Q7RTX1 1/20 0.56
GAA P10253 1/20 0.55
KMT2A Q03164 1/20 0.55
HSD17B10 Q99714 1/20 0.55
DDR1 Q08345 2/20 0.54
CCR2 P41597 1/20 0.54
P2RX1 P51575 1/20 0.52
LMNA P02545 1/20 0.52
PTGS1 P23219 1/20 0.52
TACR1 P25103 1/20 0.52
HDAC3 O15379 1/20 0.52
HDAC1 Q13547 1/20 0.52

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
SCHEMBL7674144 1.00 POLB (0.64) POLBALDH1A1NPSR1NPC1GPR139
SCHEMBL7677201 0.85 NPSR1 (0.70) POLBALDH1A1NPSR1NPC1GPR139
SCHEMBL7677272 0.85 NPSR1 (0.70) POLBALDH1A1NPSR1NPC1GPR139
SCHEMBL19112871 0.81 POLB (0.69) POLBALDH1A1NPSR1NPC1GPR139
SCHEMBL30739602 0.81 POLB (0.78) POLBALDH1A1NPSR1GPR139TP53
SCHEMBL2855037 0.81 POLB (0.78) POLBALDH1A1NPSR1GPR139TP53
SCHEMBL18086855 0.81 POLB (0.54) POLBALDH1A1NPSR1NPC1GPR139
SCHEMBL18086864 0.81 POLB (0.64) POLBALDH1A1NPSR1NPC1GPR139
Hydrochloric Acid SCHEMBL18063328 0.80 POLB (0.53) POLBALDH1A1NPSR1NPC1GPR139
Hydrochloric Acid SCHEMBL18063329 0.80 POLB (0.53) POLBALDH1A1NPSR1NPC1GPR139

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-20020052295-A1 Diacyl derivatives of propylene diamine having herbicidal activity MONSANTO TECHNOLOGY LLC 2002-05-02 US disclosed
WO-2001046152-A1 HERBICIDAL DIACYL DERIVATIVES OF PROPYLENE DIAMINE MONSANTO TECHNOLOGY LLC (US) 2001-06-28 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-20020052295-A1 Diacyl derivatives of propylene diamine having herbicidal activity DDT, SAT1, AOC1 POLB 1606/4885ALDH1A1 232/4885NPSR1 3496/4885

“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.