SCHEMBL3997432

SCHEMBL3997432

Cc1ccccc1C(O)(C(=O)NC1CCN(Cc2ccccc2)CC1)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.59
▸ CHRM2 P08172 5/20 0.55
▸ CHRM1 P11229 5/20 0.55
▸ CHRM3 P20309 5/20 0.55
▸ SIGMAR1 Q99720 3/20 0.54
▸ KMT2A Q03164 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ DRD4 P21917 2/20 0.51
▸ DRD2 P14416 1/20 0.51
▸ DRD3 P35462 1/20 0.51
▸ MAOB P27338 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ DPP7 Q9UHL4 1/20 0.50

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 0.87 CHRM2 (0.65) POLBCHRM2CHRM1CHRM3SIGMAR1
SCHEMBL3996281 0.82 CHRM2 (0.66) POLBCHRM2CHRM1CHRM3SIGMAR1
SCHEMBL3997295 0.81 SIGMAR1 (0.62) POLBCHRM2CHRM1CHRM3SIGMAR1
SCHEMBL3997077 0.80 SIGMAR1 (0.61) CHRM2CHRM1CHRM3SIGMAR1
SCHEMBL3995763 0.80 SIGMAR1 (0.67) CHRM2CHRM1CHRM3SIGMAR1DRD4
SCHEMBL3996386 0.78 CHRM2 (0.63) POLBCHRM2CHRM1CHRM3SIGMAR1
SCHEMBL13003260 0.78 SIGMAR1 (0.68) POLBCHRM2CHRM1CHRM3SIGMAR1
SCHEMBL3306841 0.78 SIGMAR1 (0.68) POLBSIGMAR1KMT2AALDH1A1DRD4
SCHEMBL2425554 0.76 SIGMAR1 (0.78) POLBSIGMAR1KMT2ADRD4DRD2
SCHEMBL17294676 0.76 CHRM3 (0.72) CHRM2CHRM1CHRM3SIGMAR1KMT2A

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 POLB 2011/4885CHRM2 3602/4885CHRM1 3826/4885

“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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