SCHEMBL4122927

SCHEMBL4122927

O=C(Nc1ccc(OC(F)F)cc1)Nc1ccc(N2CCCC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.61
KMT2A Q03164 8/20 0.61
ALDH1A1 P00352 6/20 0.61
ALOX15 P16050 3/20 0.61
HSD17B10 Q99714 2/20 0.61
USP2 O75604 2/20 0.61
SMN1; SMN2 Q16637 5/20 0.60
KDM4E B2RXH2 2/20 0.60
NPSR1 Q6W5P4 4/20 0.56
RAB9A P51151 4/20 0.56
NPC1 O15118 3/20 0.56
GAA P10253 2/20 0.56
PKM P14618 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MEN1 O00255 3/20 0.54
NR4A1 P22736 2/20 0.53
MCL1 Q07820 1/20 0.53
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C19 P33261 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
SCHEMBL4112301 0.99 MAPT (0.62) MAPTKMT2AALDH1A1ALOX15HSD17B10
SCHEMBL4118526 0.83 MAPT (0.66) MAPTKMT2AALDH1A1ALOX15HSD17B10
SCHEMBL4112800 0.79 ALDH1A1 (0.65) MAPTKMT2AALDH1A1ALOX15SMN1; SMN2
Urea SCHEMBL4110289 0.79 MAPT (0.61) MAPTKMT2AALDH1A1ALOX15SMN1; SMN2
SCHEMBL4112930 0.78 KMT2A (0.67) MAPTKMT2AALDH1A1ALOX15SMN1; SMN2
SCHEMBL4111928 0.77 MAPT (0.68) MAPTKMT2AALDH1A1HSD17B10SMN1; SMN2
SCHEMBL4115554 0.77 MEN1 (0.59) MAPTKMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL31054280 0.77 MAPT (0.69) MAPTKMT2AALDH1A1USP2SMN1; SMN2
SCHEMBL4113556 0.76 MAPT (0.72) MAPTKMT2AALDH1A1ALOX15USP2
SCHEMBL4105408 0.76 GLA (0.63) MAPTKMT2AALDH1A1HSD17B10SMN1; SMN2

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 MAPT 1654/4885KMT2A 2807/4885ALDH1A1 994/4885

“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.