SCHEMBL4112930

SCHEMBL4112930

O=C(Nc1ccc(OC(F)F)cc1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.67
ALDH1A1 P00352 5/20 0.67
MEN1 O00255 5/20 0.67
MAPT P10636 4/20 0.67
LMNA P02545 2/20 0.67
RECQL P46063 2/20 0.67
KDM4E B2RXH2 1/20 0.67
TP53 P04637 1/20 0.67
ALOX15 P16050 1/20 0.67
HTT P42858 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.64
GAA P10253 1/20 0.56
RAB9A P51151 1/20 0.56
NAMPT P43490 2/20 0.56
TSHR P16473 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
SCHEMBL4112800 0.99 ALDH1A1 (0.65) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL6886969 0.87 USP2 (0.65) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL4112301 0.80 MAPT (0.62) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL4105163 0.79 MEN1 (0.69) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL13695940 0.79 KMT2A (0.52) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL12459445 0.79 ALDH1A1 (0.56) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL30926941 0.78 KMT2A (0.53) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL27181621 0.78 KMT2A (0.53) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL4118526 0.78 MAPT (0.66) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL4122927 0.78 MAPT (0.61) KMT2AALDH1A1MEN1MAPTLMNA

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 6 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 claimed
EP-1804785-A2 DIARYL UREAS AS CB1 ANTAGONISTS NEUROGEN CORPORATION (US) 2007-07-11 EP claimed
WO-2006049941-A2 DIARYL UREAS AS CB1 ANTAGONISTS NEUROGEN CORPORATION (US) 2006-05-11 WO claimed
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 KMT2A 2807/4885ALDH1A1 994/4885MEN1 3273/4885

“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.