SCHEMBL3995763

SCHEMBL3995763

CC(C)C(O)(C(=O)NC1CCN(Cc2ccccc2)CC1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 4/20 0.67
▸ UBE2M P61081 7/20 0.63
▸ DCUN1D1 Q96GG9 7/20 0.63
▸ CHRM2 P08172 4/20 0.57
▸ CHRM1 P11229 4/20 0.57
▸ CHRM3 P20309 4/20 0.57
▸ DRD4 P21917 2/20 0.55
▸ CCR2 P41597 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
SCHEMBL6952267 0.90 CHRM2 (0.65) SIGMAR1CHRM2CHRM1CHRM3DRD4
SCHEMBL3996281 0.89 CHRM2 (0.66) SIGMAR1UBE2MDCUN1D1CHRM2CHRM1
SCHEMBL3997295 0.86 SIGMAR1 (0.62) SIGMAR1CHRM2CHRM1CHRM3
SCHEMBL3997077 0.85 SIGMAR1 (0.61) SIGMAR1UBE2MDCUN1D1CHRM2CHRM1
SCHEMBL3997432 0.80 POLB (0.59) SIGMAR1CHRM2CHRM1CHRM3DRD4
SCHEMBL3996386 0.79 CHRM2 (0.63) SIGMAR1CHRM2CHRM1CHRM3DRD4
SCHEMBL18640301 0.78 DCUN1D1 (1.00) SIGMAR1UBE2MDCUN1D1DRD4
SCHEMBL17294676 0.77 CHRM3 (0.72) SIGMAR1CHRM2CHRM1CHRM3DRD4
SCHEMBL5402061 0.77 SIGMAR1 (0.68) SIGMAR1CHRM2CHRM1CHRM3DRD4
SCHEMBL6950046 0.76 CHRM2 (0.58) SIGMAR1CHRM2CHRM1CHRM3DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2066619-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS Arete Therapeutics, INC. (US) 2009-06-10 — — EP claimed
US-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-21 — — US claimed
WO-2008073623-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-06-19 — — WO claimed
EP-2066619-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS Arete Therapeutics, INC. (US) 2009-06-10 — — EP disclosed
US-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-21 — — US disclosed
US-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-21 — — US disclosed
US-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-21 — — US disclosed
WO-2008073623-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-06-19 — — WO disclosed
WO-2008073623-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-06-19 — — 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 (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-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS EPHX1, EPHX2, NCEH1 SIGMAR1 2688/4885UBE2M 3036/4885DCUN1D1 4095/4885

“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.

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