SCHEMBL4124277

SCHEMBL4124277

CCc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.74
KMT2A Q03164 7/20 0.74
MAPT P10636 5/20 0.65
NPC1 O15118 4/20 0.65
MAPK1 P28482 2/20 0.65
LMNA P02545 2/20 0.65
SMN1; SMN2 Q16637 2/20 0.65
RAB9A P51151 4/20 0.62
NPSR1 Q6W5P4 1/20 0.62
MYOC Q99972 1/20 0.62
POLB P06746 2/20 0.59
ABCG2 Q9UNQ0 1/20 0.58
HTT P42858 3/20 0.57
CNR1 P21554 1/20 0.57
PTGES O14684 1/20 0.56
GAA P10253 1/20 0.56
ALDH1A1 P00352 1/20 0.55

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
SCHEMBL11047722 1.00 MEN1 (0.74) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL8956783 0.93 MEN1 (0.64) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL4110398 0.88 ABCG2 (0.73) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL15306499 0.87 CNR1 (0.77) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL11972987 0.86 LMNA (0.70) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL1177730 0.86 MEN1 (1.00) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL6302157 0.86 MEN1 (1.00) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL11069641 0.86 ALDH1A1 (0.67) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL4122859 0.86 MEN1 (0.73) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL4118564 0.86 GAA (0.73) MEN1KMT2AMAPTNPC1MAPK1

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 2 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

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 3273/4885KMT2A 2807/4885MAPT 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.