SCHEMBL22462817

SCHEMBL22462817

CC1C(OCc2ccc(C(F)(F)F)cc2)CN1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 2/20 0.44
▸ NAAA Q02083 1/20 0.43
▸ GRM2 Q14416 1/20 0.42
▸ GRM3 Q14832 1/20 0.42
▸ TACR1 P25103 5/20 0.42
▸ LIPG Q9Y5X9 1/20 0.42
▸ MAOB P27338 2/20 0.41
▸ CARM1 Q86X55 1/20 0.41
▸ PRMT6 Q96LA8 1/20 0.41
▸ MGLL Q99685 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.40
▸ SLC6A5 Q9Y345 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ MMP2 P08253 1/20 0.39
▸ MMP13 P45452 1/20 0.39

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
SCHEMBL22462867 0.85 TACR1 (0.42) TEAD1NAAAGRM2GRM3TACR1
SCHEMBL21723019 0.82 IDO1 (0.44) TACR1LIPGIDO1
SCHEMBL27160337 0.76 TEAD1 (0.48) TEAD1NAAAGRM2GRM3TACR1
SCHEMBL27629882 0.71 CARM1 (0.57) TEAD1NAAAGRM2GRM3TACR1
SCHEMBL31421360 0.71 TACR1 (0.44) TEAD1TACR1
SCHEMBL27160520 0.71 TEAD1 (0.43) TEAD1NAAAGRM2GRM3TACR1
SCHEMBL30881252 0.70 TEAD1 (0.45) TEAD1NAAAGRM2GRM3TACR1
SCHEMBL30881227 0.70 TEAD1 (0.45) TEAD1NAAATACR1
SCHEMBL27246561 0.70 IDO1 (0.45) NAAATACR1MAOBCARM1PRMT6
SCHEMBL21722995 0.69 TACR1 (0.42) NAAATACR1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3837263-B1 NEW HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN LA ROCHE (CH) 2024-07-03 — — EP disclosed
US-20240150373-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2024-05-09 — — US disclosed
US-11802133-B2 Heterocyclic compounds as monoacylglycerol lipase inhibitors HOFFMANN-LA ROCHE INC. (US) 2023-10-31 — — US disclosed
US-20230050901-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2023-02-16 — — US disclosed
US-20210277020-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2021-09-09 — — US disclosed
US-20200308190-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2020-10-01 — — 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 (5 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-20210277020-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS MGLL, PNLIP, LPL TEAD1 3322/4885NAAA 60/4885GRM2 2681/4885
US-20240150373-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS LIPC, LPL, MGLL TEAD1 3988/4885NAAA 54/4885GRM2 3518/4885
US-20200308190-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS LIPC, MGLL, LPL TEAD1 4117/4885NAAA 50/4885GRM2 3514/4885
US-11802133-B2 Heterocyclic compounds as monoacylglycerol lipase inhibitors LIPC, LPL, MGLL TEAD1 3988/4885NAAA 54/4885GRM2 3518/4885
US-20230050901-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS LIPC, LPL, MGLL TEAD1 3988/4885NAAA 54/4885GRM2 3518/4885

“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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