SCHEMBL4113233

SCHEMBL4113233

Cc1cccc(NC(=O)Nc2cccc(OC(F)F)c2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.65
MAPT P10636 7/20 0.65
SMN1; SMN2 Q16637 6/20 0.65
MEN1 O00255 6/20 0.65
LMNA P02545 5/20 0.65
HTT P42858 4/20 0.65
NPSR1 Q6W5P4 3/20 0.65
EPHX2 P34913 1/20 0.56
PKM P14618 1/20 0.56
ALDH1A1 P00352 4/20 0.56
FAAH O00519 1/20 0.56
CYP3A4 P08684 1/20 0.56
MAPK1 P28482 1/20 0.56
CDK8 P49336 1/20 0.55
ATM Q13315 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
SAE1 Q9UBE0 1/20 0.55
UBA2 Q9UBT2 1/20 0.55
GRM4 Q14833 2/20 0.54
CASP3 P42574 1/20 0.53

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
SCHEMBL4116278 0.93 MAPT (0.56) KMT2AMAPTSMN1; SMN2MEN1LMNA
SCHEMBL4104678 0.92 KMT2A (0.68) KMT2AMAPTSMN1; SMN2MEN1LMNA
SCHEMBL4106286 0.91 MAPT (0.65) KMT2AMAPTSMN1; SMN2MEN1LMNA
SCHEMBL4117429 0.90 MAPT (0.62) KMT2AMAPTSMN1; SMN2MEN1LMNA
SCHEMBL4107026 0.87 MAPT (0.57) KMT2AMAPTSMN1; SMN2MEN1LMNA
SCHEMBL4118285 0.87 CA2 (0.64) KMT2AMAPTSMN1; SMN2MEN1LMNA
SCHEMBL4112724 0.87 TP53 (0.70) KMT2AMAPTSMN1; SMN2MEN1LMNA
SCHEMBL4118632 0.86 MAPT (0.64) KMT2AMAPTSMN1; SMN2MEN1LMNA
SCHEMBL4124728 0.86 MAPT (0.57) KMT2AMAPTSMN1; SMN2MEN1LMNA
SCHEMBL4123178 0.86 MAPT (0.60) KMT2AMAPTSMN1; SMN2MEN1LMNA

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 2807/4885MAPT 1654/4885SMN1; SMN2 4056/4885

“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.