SCHEMBL4122424

SCHEMBL4122424

N#CCOc1ccc(NC(=O)Nc2cccc(F)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 2/20 0.56
MEN1 O00255 8/20 0.55
KMT2A Q03164 8/20 0.55
RAB9A P51151 7/20 0.55
NPC1 O15118 5/20 0.55
MAPT P10636 4/20 0.55
MTOR P42345 1/20 0.54
ALDH1A1 P00352 2/20 0.51
KDR P35968 2/20 0.51
BRAF P15056 1/20 0.50
GAA P10253 1/20 0.50
FLT3 P36888 1/20 0.49
MITF O75030 1/20 0.49
PAX8 Q06710 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
CASP3 P42574 1/20 0.49

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
SCHEMBL4107055 0.88 MAPT (0.49) CDK8MEN1KMT2ARAB9ANPC1
SCHEMBL4112803 0.86 MEN1 (0.53) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL4113183 0.86 MAPT (0.70) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL31054229 0.85 PPARA (0.58) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL4111854 0.85 MAPT (0.67) CDK8MEN1KMT2ARAB9ANPC1
SCHEMBL4106349 0.85 SAE1 (0.59) CDK8MEN1KMT2ARAB9ANPC1
SCHEMBL4113342 0.84 MAPT (0.50) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL4124140 0.84 MEN1 (0.57) CDK8MEN1KMT2ARAB9ANPC1
SCHEMBL4123109 0.84 TSHR (0.71) CDK8MEN1KMT2ARAB9ANPC1
SCHEMBL4104448 0.83 ALDH1A1 (0.70) CDK8MEN1KMT2ARAB9ANPC1

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 CDK8 1510/4885MEN1 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.