SCHEMBL3961059

SCHEMBL3961059

O=C(Nc1cccc(F)c1)NC1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.78
MEN1 O00255 8/20 0.78
MAPT P10636 4/20 0.78
HTT P42858 2/20 0.69
XBP1 P17861 1/20 0.69
NPY1R P25929 1/20 0.67
NPY2R P49146 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
LMNA P02545 3/20 0.66
SMN1; SMN2 Q16637 3/20 0.61
GAA P10253 2/20 0.61
ALDH1A1 P00352 3/20 0.59
POLB P06746 1/20 0.59
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
EPHX2 P34913 2/20 0.57
PKM P14618 1/20 0.53
TSHR P16473 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
SCHEMBL3960573 0.90 KMT2A (0.79) KMT2AMEN1MAPTHTTXBP1
SCHEMBL3959599 0.87 KMT2A (0.80) KMT2AMEN1MAPTHTTXBP1
SCHEMBL3960575 0.87 MAPT (0.84) KMT2AMEN1MAPTHTTXBP1
SCHEMBL14085440 0.83 KMT2A (0.68) KMT2AMEN1MAPTHTTXBP1
SCHEMBL3959067 0.83 MAPT (0.80) KMT2AMEN1MAPTHTTXBP1
SCHEMBL3960566 0.82 KMT2A (0.70) KMT2AMEN1MAPTHTTXBP1
SCHEMBL1425676 0.81 KMT2A (0.89) KMT2AMEN1MAPTHTTXBP1
SCHEMBL4015609 0.80 EPHX1 (0.76) KMT2AMEN1MAPTHTTXBP1
SCHEMBL3965492 0.80 MEN1 (0.62) KMT2AMEN1MAPTHTTNPY1R
SCHEMBL3960891 0.79 MAPT (0.89) KMT2AMEN1MAPTHTTXBP1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247521-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. 2009-10-01 US claimed
CN-101535259-A Phenylurea compounds as soluble epoxide hydrolase inhibitors ARETE THERAPEUTICS INC (US) 2009-09-16 CN claimed
EP-2079695-A2 PHENYLUREA COMPOUNDS AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS Arete Therapeutics, INC. (US) 2009-07-22 EP claimed
WO-2009086426-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. (US) 2009-07-09 WO claimed
US-20080221100-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-09-11 US claimed
WO-2008051873-A2 PHENYLUREA COMPOUNDS AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-05-02 WO claimed
US-20090247521-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. 2009-10-01 US disclosed
US-20090247521-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. 2009-10-01 US disclosed
US-20090247521-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. 2009-10-01 US disclosed
CN-101535259-A Phenylurea compounds as soluble epoxide hydrolase inhibitors ARETE THERAPEUTICS INC (US) 2009-09-16 CN disclosed
EP-2079695-A2 PHENYLUREA COMPOUNDS AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS Arete Therapeutics, INC. (US) 2009-07-22 EP disclosed
WO-2009086426-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. (US) 2009-07-09 WO disclosed
WO-2009086426-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. (US) 2009-07-09 WO disclosed
US-20080221100-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-09-11 US disclosed
US-20080221100-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-09-11 US disclosed
US-20080221100-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-09-11 US disclosed
WO-2008051873-A2 PHENYLUREA COMPOUNDS AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-05-02 WO disclosed
WO-2008051873-A2 PHENYLUREA COMPOUNDS AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-05-02 WO 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 (2 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-20090247521-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION EPHX1, ECE1, LIPG KMT2A 4287/4885MEN1 4861/4885MAPT 3633/4885
US-20080221100-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS EPHX1, EPHX2, NCEH1 KMT2A 3884/4885MEN1 3797/4885MAPT 3982/4885

“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.