SCHEMBL4228409

SCHEMBL4228409

CCC(CC)NC(=O)Nc1cc(F)c(Oc2ccc(CC(C)(C)OC(N)=O)cc2)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.45
TAS1R3 Q7RTX0 2/20 0.43
TAS1R1 Q7RTX1 2/20 0.43
POLB P06746 2/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.34
CTSK P43235 1/20 0.34
KDR P35968 1/20 0.33
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
SOAT1 P35610 1/20 0.32
FPR2 P25090 1/20 0.32
CYP3A4 P08684 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
NFKB1 P19838 1/20 0.32
CYP2C19 P33261 1/20 0.32
OPRM1 P35372 3/20 0.31
OPRD1 P41143 3/20 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
SCHEMBL4226776 0.84 PKM (0.54) PKMTAS1R3TAS1R1POLBMAPK1
SCHEMBL4226773 0.82 PKM (0.52) PKMTAS1R3TAS1R1POLBMAPK1
SCHEMBL4233639 0.82 TAS1R3 (0.62) PKMTAS1R3TAS1R1CTSK
SCHEMBL4227148 0.80 PKM (0.49) PKMTAS1R3TAS1R1POLBFPR2
SCHEMBL4744778 0.78 PKM (0.52) PKMTAS1R3TAS1R1POLBMAPK1
SCHEMBL4233830 0.78 PKM (0.45) PKMTAS1R3TAS1R1POLBMAPK1
SCHEMBL4233396 0.78 PKM (0.52) PKMTAS1R3TAS1R1POLBFPR2
SCHEMBL4241020 0.78 OPRK1 (0.37) CARM1PRMT6CYP3A4CYP1A2CYP2D6
SCHEMBL4238103 0.78 PKM (0.42) PKMTAS1R3TAS1R1CTSKCYP2C9
SCHEMBL4236321 0.76 PKM (0.47) PKMTAS1R3TAS1R1MAPK1CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R PKM 1734/4885TAS1R3 1436/4885TAS1R1 1073/4885

“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.