SCHEMBL4112992

SCHEMBL4112992

O=C(Nc1ccc(OC(F)F)cc1)Nc1cccc(-c2cnc3ccccc3c2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.70
CNR2 P34972 1/20 0.70
MAPT P10636 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MEN1 O00255 1/20 0.54
LMNA P02545 1/20 0.54
HTT P42858 1/20 0.54
KMT2A Q03164 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
MAP4K4 O95819 1/20 0.49
CSNK1G2 P78368 1/20 0.49
CLK4 Q9HAZ1 1/20 0.49
MKNK2 Q9HBH9 1/20 0.49
MAP4K5 Q9Y4K4 1/20 0.49
NPC1 O15118 1/20 0.48
POLB P06746 1/20 0.48
RAB9A P51151 1/20 0.48
MMP9 P14780 1/20 0.44
GRM4 Q14833 1/20 0.44
MGLL Q99685 1/20 0.44

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
SCHEMBL4105514 0.88 MAPT (0.57) CNR1CNR2MAPTSMN1; SMN2MEN1
SCHEMBL4119173 0.86 NPC1 (0.65) CNR1CNR2MAPTSMN1; SMN2MEN1
SCHEMBL4112489 0.83 MAPT (0.67) CNR1MAPTSMN1; SMN2MEN1LMNA
SCHEMBL20557650 0.82 CNR1 (1.00) CNR1CNR2
SCHEMBL30469270 0.82 CNR1 (1.00) CNR1CNR2
SCHEMBL4107193 0.80 MAPT (0.53) CNR1CNR2MAPTSMN1; SMN2MEN1
SCHEMBL4111786 0.80 CNR1 (0.66) CNR1CNR2MAPTSMN1; SMN2MEN1
SCHEMBL4117235 0.79 CNR1 (0.67) CNR1CNR2MAPTSMN1; SMN2MEN1
SCHEMBL4118244 0.79 MAPT (0.59) CNR1MAPTSMN1; SMN2MEN1LMNA
SCHEMBL4281705 0.79 KDM4E (0.56) CNR1MAPTSMN1; SMN2MEN1LMNA

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 CNR1 1/4885CNR2 2/4885MAPT 1654/4885

“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.