SCHEMBL4010903

SCHEMBL4010903

O=C(NC1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1)NC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.69
USP2 O75604 1/20 0.69
MAPT P10636 1/20 0.57
XBP1 P17861 1/20 0.57
HTT P42858 1/20 0.57
EPHX2 P34913 9/20 0.54
EPHX1 P07099 6/20 0.54
L3MBTL1 Q9Y468 1/20 0.50
CNR1 P21554 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
KMT2A Q03164 1/20 0.48
GAA P10253 1/20 0.48

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
SCHEMBL3962534 0.89 LMNA (0.56) LMNAUSP2MAPTXBP1HTT
SCHEMBL4011026 0.88 GAA (0.62) LMNAUSP2MAPTXBP1HTT
SCHEMBL4541867 0.85 CNR1 (0.51) LMNAUSP2HTTEPHX2EPHX1
SCHEMBL4016231 0.85 USP2 (0.71) LMNAUSP2EPHX2EPHX1KMT2A
SCHEMBL3958219 0.84 EPHX2 (0.56) LMNAUSP2EPHX2EPHX1
SCHEMBL4881964 0.84 HTT (0.52) LMNAUSP2MAPTXBP1HTT
SCHEMBL4540476 0.83 EPHX2 (0.51) LMNAUSP2EPHX2EPHX1L3MBTL1
SCHEMBL4009897 0.83 CNR1 (0.65) LMNAMAPTXBP1HTTEPHX2
SCHEMBL4537706 0.82 EPHX2 (0.48) LMNAUSP2EPHX2EPHX1L3MBTL1
SCHEMBL4434549 0.81 LMNA (0.67) LMNAUSP2HTTEPHX2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101679258-A 4-piperidinylurea compounds as soluble epoxide hydrolase inhibitors ARETE THERAPEUTICS INC 2010-03-24 CN claimed
US-20090247521-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. 2009-10-01 US claimed
WO-2009086426-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. (US) 2009-07-09 WO claimed
US-20080227780-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-09-18 US 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
WO-2009086426-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. (US) 2009-07-09 WO disclosed
US-20080227780-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-09-18 US disclosed
US-20080227780-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-09-18 US disclosed
US-20080227780-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-09-18 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 (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 LMNA 2489/4885USP2 157/4885MAPT 3633/4885
US-20080227780-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS EPHX1, EPHX2, NCEH1 LMNA 2479/4885USP2 182/4885MAPT 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.