SCHEMBL4111990

SCHEMBL4111990

CCOC(=O)c1ccc(NC(=O)Nc2cccc(OCC)c2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.77
MEN1 O00255 6/20 0.77
KMT2A Q03164 6/20 0.77
SMN1; SMN2 Q16637 6/20 0.77
NPC1 O15118 5/20 0.77
RAB9A P51151 5/20 0.77
TRPV1 Q8NER1 2/20 0.71
CASP3 P42574 1/20 0.65
SENP7 Q9BQF6 1/20 0.65
GAA P10253 1/20 0.62
MITF O75030 1/20 0.62
PAX8 Q06710 1/20 0.62
CA12 O43570 2/20 0.60
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
CA9 Q16790 2/20 0.60
USP2 O75604 1/20 0.58
LMNA P02545 1/20 0.58
MAPK1 P28482 1/20 0.58
ALDH1A1 P00352 1/20 0.56

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
SCHEMBL4110981 0.91 KMT2A (0.83) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4106147 0.91 KMT2A (0.64) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4117810 0.90 TRPV1 (0.65) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4122551 0.90 MAPT (0.72) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4107148 0.88 TRPV1 (0.68) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4128090 0.87 MAPT (1.00) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4106982 0.87 KMT2A (0.66) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4124085 0.87 MAPT (0.81) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4109903 0.87 RAB9A (0.64) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4111027 0.86 TRPV1 (0.67) MAPTMEN1KMT2ASMN1; SMN2NPC1

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 MAPT 1654/4885MEN1 3273/4885KMT2A 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.