SCHEMBL4126907

SCHEMBL4126907

CCCOc1ccc(NC(=O)Nc2cc(C)cc(C)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.58
CA1 P00915 3/20 0.58
CA2 P00918 3/20 0.58
CA9 Q16790 3/20 0.58
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
EPHX2 P34913 1/20 0.56
MAPT P10636 7/20 0.54
POLB P06746 1/20 0.54
FAAH O00519 1/20 0.53
RAB9A P51151 4/20 0.53
NPC1 O15118 2/20 0.53
RXFP1 Q9HBX9 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
PKM P14618 1/20 0.52
ALDH1A1 P00352 2/20 0.52
GAA P10253 1/20 0.52
MAPK1 P28482 1/20 0.52
PABPC1 P11940 1/20 0.51
KDM4E B2RXH2 1/20 0.51

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
SCHEMBL4124890 0.89 EPHX2 (0.60) CA12CA1CA2CA9MEN1
SCHEMBL4111879 0.88 MAPT (0.69) CA12CA1CA2CA9MEN1
SCHEMBL4112924 0.87 SAE1 (0.62) CA12CA1CA2CA9MEN1
SCHEMBL4113295 0.83 RAB9A (0.71) CA12CA1CA2CA9MEN1
SCHEMBL4104949 0.83 PPARA (0.68) CA12CA1CA2CA9EPHX2
SCHEMBL4112277 0.82 HRH3 (0.72) CA12CA1CA2CA9MEN1
SCHEMBL4113719 0.82 EPHX2 (0.59) CA12CA1CA2CA9MEN1
SCHEMBL4106567 0.82 FAAH (0.68) CA12CA1CA2CA9MEN1
SCHEMBL4112694 0.81 MAPT (0.62) CA12CA1CA2CA9MEN1
SCHEMBL13756245 0.80 MEN1 (0.85) CA12CA1CA2CA9MEN1

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 CA12 4452/4885CA1 3551/4885CA2 4345/4885

“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.