SCHEMBL18935852

SCHEMBL18935852

CC(C)(C)CN(CCc1ccccc1)C(=O)n1ncc(-c2ccc(OC(F)(F)F)cc2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 10/20 1.00
DAGLB Q8NCG7 7/20 0.85
DDHD2 O94830 1/20 0.66
SERPINE1 P05121 1/20 0.39
GCGR P47871 2/20 0.38
GRIN2B Q13224 1/20 0.37
LIPE Q05469 1/20 0.37
MCHR1 Q99705 1/20 0.37
CHRM4 P08173 1/20 0.36
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
ABHD6 Q9BV23 1/20 0.36

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
SCHEMBL18935831 0.92 DAGLA (1.00) DAGLADAGLBDDHD2GCGRGRIN2B
SCHEMBL18935832 0.91 DAGLA (1.00) DAGLADAGLBDDHD2
SCHEMBL18935851 0.86 DAGLA (1.00) DAGLADAGLBDDHD2SERPINE1GCGR
SCHEMBL18935850 0.85 DAGLA (1.00) DAGLADAGLBDDHD2SERPINE1GCGR
SCHEMBL20576782 0.81 DAGLA (0.69) DAGLADAGLBDDHD2SERPINE1GCGR
SCHEMBL18935859 0.81 DAGLA (1.00) DAGLADAGLBDDHD2SERPINE1GCGR
SCHEMBL18935828 0.81 DAGLA (1.00) DAGLADAGLBDDHD2SERPINE1GCGR
SCHEMBL29659427 0.79 DDHD2 (1.00) DAGLADAGLBDDHD2SERPINE1GCGR
SCHEMBL18921268 0.79 DAGLB (1.00) DAGLADAGLBDDHD2GCGRGRIN2B
SCHEMBL18935782 0.78 DAGLA (1.00) DAGLADAGLBDDHD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10583137-B2 Triazole DAGLα inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2020-03-10 US disclosed
US-20180344729-A1 TRIAZOLE DAGLAlpha INHIBITORS THE SCRIPPS RESEARCH INSTITUTE 2018-12-06 US disclosed
WO-2017096315-A1 TRIAZOLE DAGL(α) INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2017-06-08 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 (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-10583137-B2 Triazole DAGLα inhibitors DAGLB, DAGLA, DGKB DAGLA 2/4885DAGLB 1/4885DDHD2 2253/4885
US-20180344729-A1 TRIAZOLE DAGLAlpha INHIBITORS DAGLB, DAGLA, DGKB DAGLA 2/4885DAGLB 1/4885DDHD2 1590/4885

“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.