SCHEMBL4124294

SCHEMBL4124294

O=C(Nc1ccc(OC(F)F)cc1)Nc1cc(OC(F)F)ncn1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.52
TNNI3K Q59H18 12/20 0.52
MAPK14 Q16539 10/20 0.52
MEN1 O00255 1/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
BRAF P15056 8/20 0.51
RAF1 P04049 2/20 0.47
STING1 Q86WV6 1/20 0.46
ALDH1A1 P00352 1/20 0.45

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
SCHEMBL4113174 0.91 TP53 (0.53) KDRTNNI3KMAPK14MEN1LMNA
SCHEMBL5198659 0.90 KDR (0.51) KDRTNNI3KMAPK14MEN1LMNA
SCHEMBL4118526 0.80 MAPT (0.66) MEN1LMNAMAPTHTTKMT2A
SCHEMBL4111952 0.79 TP53 (0.73) MEN1LMNAMAPTHTTKMT2A
SCHEMBL4124271 0.76 RAB9A (0.64) MEN1LMNAMAPTHTTKMT2A
Urea SCHEMBL4110289 0.76 MAPT (0.61) MEN1LMNAMAPTHTTKMT2A
SCHEMBL4112485 0.75 KDM4E (0.70) MEN1LMNAMAPTHTTKMT2A
SCHEMBL4105198 0.75 MAPT (0.68) MEN1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL4121124 0.74 RAB9A (0.67) MEN1LMNAMAPTHTTKMT2A
SCHEMBL4115554 0.74 MEN1 (0.59) MEN1LMNAMAPTHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090239841-A1 Diaryl Ureas as CB1 Antagonists NEUROGEN CORPORATION 2009-09-24 US claimed
EP-1804785-A2 DIARYL UREAS AS CB1 ANTAGONISTS NEUROGEN CORPORATION (US) 2007-07-11 EP claimed
WO-2006049941-A2 DIARYL UREAS AS CB1 ANTAGONISTS NEUROGEN CORPORATION (US) 2006-05-11 WO claimed
US-20090239841-A1 Diaryl Ureas as CB1 Antagonists NEUROGEN CORPORATION 2009-09-24 US disclosed
US-20090239841-A1 Diaryl Ureas as CB1 Antagonists NEUROGEN CORPORATION 2009-09-24 US disclosed
US-20090239841-A1 Diaryl Ureas as CB1 Antagonists NEUROGEN CORPORATION 2009-09-24 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-20090239841-A1 Diaryl Ureas as CB1 Antagonists CNR1, CNR2, OPRL1 KDR 3246/4885TNNI3K 4016/4885MAPK14 3162/4885

“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.