SCHEMBL4004148

SCHEMBL4004148

CS(=O)(=O)c1ccc(NC(=O)Nc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.72
CA1 P00915 2/20 0.72
CA2 P00918 2/20 0.72
CA9 Q16790 2/20 0.72
MAPT P10636 2/20 0.72
EPHX2 P34913 4/20 0.71
IDH1 O75874 2/20 0.69
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
HTT P42858 1/20 0.56
RAB9A P51151 1/20 0.56
TRPV4 Q9HBA0 1/20 0.56
IDO1 P14902 1/20 0.56
P2RY1 P47900 1/20 0.55
AKR1C3 P42330 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
SCHEMBL4004795 0.86 BAZ1A (0.64) CA12CA1CA2CA9MAPT
SCHEMBL4002880 0.84 MAPT (0.68) CA12CA1CA2CA9MAPT
SCHEMBL28729179 0.84 EPHX2 (1.00) CA12CA1CA2CA9MAPT
SCHEMBL11003408 0.84 EPHX2 (1.00) CA12CA1CA2CA9MAPT
SCHEMBL668108 0.84 CA1 (1.00) CA12CA1CA2CA9MAPT
SCHEMBL20725356 0.83 IDH1 (1.00) IDH1
SCHEMBL863126 0.82 PTGS2 (0.68) CA1CA2AKR1C3
SCHEMBL5594038 0.82 TRPV4 (0.54) CA12CA1CA2CA9MAPT
SCHEMBL4005055 0.82 IDO1 (0.65) CA12CA1CA2CA9MAPT
SCHEMBL3346579 0.81 MAPT (0.68) CA12CA1CA2CA9MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270452-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF SMOOTH MUSCLE DISORDERS ARETE THERAPEUTICS, INC. 2009-10-29 US claimed
WO-2009129501-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF SMOOTH MUSCLE DISORDERS ARETE THERAPEUTICS, INC. (US) 2009-10-22 WO claimed
CN-101516838-A Soluble epoxide hydrolase inhibitors ARETE THERAPEUTICS INC (US) 2009-08-26 CN claimed
EP-2069294-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS Arete Therapeutics, INC. (US) 2009-06-17 EP claimed
US-20080207622-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-28 US claimed
WO-2008039999-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-04-03 WO claimed
US-20100063583-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF INFLAMMATORY VASCULAR DISEASES ARETE THERAPEUTICS, INC. 2010-03-11 US disclosed
US-20100063583-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF INFLAMMATORY VASCULAR DISEASES ARETE THERAPEUTICS, INC. 2010-03-11 US disclosed
WO-2010025043-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF INFLAMMATORY VASCULAR DISEASES ARETE THERAPEUTICS, INC. (US) 2010-03-04 WO disclosed
US-20090270452-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF SMOOTH MUSCLE DISORDERS ARETE THERAPEUTICS, INC. 2009-10-29 US disclosed
US-20090270452-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF SMOOTH MUSCLE DISORDERS ARETE THERAPEUTICS, INC. 2009-10-29 US disclosed
US-20090270452-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF SMOOTH MUSCLE DISORDERS ARETE THERAPEUTICS, INC. 2009-10-29 US disclosed
WO-2009129501-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF SMOOTH MUSCLE DISORDERS ARETE THERAPEUTICS, INC. (US) 2009-10-22 WO disclosed
WO-2009129501-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF SMOOTH MUSCLE DISORDERS ARETE THERAPEUTICS, INC. (US) 2009-10-22 WO disclosed
EP-2069294-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS Arete Therapeutics, INC. (US) 2009-06-17 EP disclosed
US-20080207622-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-28 US disclosed
US-20080207622-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-28 US disclosed
US-20080207622-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-28 US disclosed
WO-2008039999-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-04-03 WO disclosed
WO-2008039999-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-04-03 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 (3 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-20090270452-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF SMOOTH MUSCLE DISORDERS EPHX1, PTGIS, PDE3A CA12 4380/4885CA1 2937/4885CA2 2929/4885
US-20100063583-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF INFLAMMATORY VASCULAR DISEASES ALOX15B, ALOX15, ALOX12 CA12 1900/4885CA1 856/4885CA2 1480/4885
US-20080207622-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS EPHX1, EPHX2, NCEH1 CA12 2404/4885CA1 1212/4885CA2 1906/4885

“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.