SCHEMBL3225244

SCHEMBL3225244

NC(=O)N(CCCCCCC(F)C(=O)O)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL4012344 1.00 MAPT (0.40) MAPTALDH1A1ALOX15
SCHEMBL4012098 1.00 MAPT (0.40) MAPTALDH1A1ALOX15
SCHEMBL4016417 0.99 MAPT (0.37) MAPTALDH1A1ALOX15
SCHEMBL4010390 0.91 EPHX1 (0.31) ALDH1A1
SCHEMBL4012362 0.88 SMN1; SMN2 (0.33) MAPTALDH1A1
SCHEMBL4014043 0.85 ALDH1A1 (0.34) MAPTALDH1A1
SCHEMBL3226887 0.84 CNR2 (0.33) MAPTALDH1A1
SCHEMBL4010715 0.84 CNR2 (0.33) MAPTALDH1A1
SCHEMBL4010984 0.84 CNR2 (0.33) MAPTALDH1A1
SCHEMBL4012089 0.83 EPHX2 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100063583-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF INFLAMMATORY VASCULAR DISEASES ARETE THERAPEUTICS, INC. 2010-03-11 US claimed
WO-2010025043-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF INFLAMMATORY VASCULAR DISEASES ARETE THERAPEUTICS, INC. (US) 2010-03-04 WO claimed
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
US-20090247521-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. 2009-10-01 US claimed
WO-2009086429-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2009-07-09 WO claimed
WO-2009086426-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. (US) 2009-07-09 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
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
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
US-20090247521-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION ARETE THERAPEUTICS, INC. 2009-10-01 US disclosed
WO-2009086429-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS 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

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-20090247521-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS FOR THE TREATMENT OF ENDOTHELIAL DYSFUNCTION EPHX1, ECE1, LIPG MAPT 3633/4885ALDH1A1 334/4885ALOX15 65/4885
US-20090270452-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF SMOOTH MUSCLE DISORDERS EPHX1, PTGIS, PDE3A MAPT 4615/4885ALDH1A1 625/4885ALOX15 129/4885
US-20100063583-A1 USE OF SOLUBLE EPOXIDE HYDROLASE INHIBITORS IN THE TREATMENT OF INFLAMMATORY VASCULAR DISEASES ALOX15B, ALOX15, ALOX12 MAPT 4737/4885ALDH1A1 526/4885ALOX15 2/4885

“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.