SCHEMBL4125166

SCHEMBL4125166

Cc1ccc(NC(=O)Nc2cccc(C#N)c2)cc1F

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.68
MAPT P10636 3/20 0.68
KMT2A Q03164 3/20 0.68
ALDH1A1 P00352 1/20 0.68
KCNJ6 P48051 1/20 0.63
KCNJ5 P48544 1/20 0.63
KCNJ3 P48549 1/20 0.63
NPC1 O15118 4/20 0.60
RAB9A P51151 3/20 0.60
LMNA P02545 2/20 0.60
HTT P42858 2/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
GAA P10253 1/20 0.59
ALOX15 P16050 1/20 0.59
CASP7 P55210 1/20 0.59
HSD17B10 Q99714 1/20 0.59
NSD2 O96028 1/20 0.53
PDK1 Q15118 1/20 0.52
PDK2 Q15119 1/20 0.52
PDK3 Q15120 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
SCHEMBL4113462 0.87 MAPT (0.73) MEN1MAPTKMT2AALDH1A1KCNJ6
SCHEMBL30606801 0.84 MAPT (0.87) MEN1MAPTKMT2AALDH1A1KCNJ6
SCHEMBL29580531 0.84 MAPT (0.87) MEN1MAPTKMT2AALDH1A1KCNJ6
SCHEMBL4112467 0.84 MAPT (0.68) MEN1MAPTKMT2AALDH1A1KCNJ6
SCHEMBL4117070 0.83 MAPT (0.80) MEN1MAPTKMT2AALDH1A1KCNJ6
SCHEMBL4118553 0.82 NPC1 (0.69) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL4115751 0.81 NPC1 (0.67) MEN1MAPTKMT2AKCNJ6KCNJ5
SCHEMBL4122903 0.81 NPC1 (0.71) MEN1MAPTKMT2AKCNJ6KCNJ5
SCHEMBL7248947 0.81 MAPT (1.00) MEN1MAPTKMT2AALDH1A1KCNJ6
SCHEMBL4115616 0.80 NPC1 (0.65) MEN1MAPTKMT2AALDH1A1KCNJ6

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 3 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 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 MEN1 3273/4885MAPT 1654/4885KMT2A 2807/4885

“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.