SCHEMBL21818581

SCHEMBL21818581

Cn1nc2c(c1-c1ccccc1)CCN(C(=O)c1cnc3ccccc3c1)C2

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 6/20 0.58
▸ MGLL Q99685 2/20 0.44
▸ DPP4 P27487 1/20 0.44
▸ MGAM O43451 1/20 0.43
▸ PRLHR P49683 3/20 0.43
▸ PIK3CA P42336 2/20 0.43
▸ CAPN1 P07384 1/20 0.43
▸ PIK3CD O00329 1/20 0.41
▸ MTOR P42345 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ MTHFD2 P13995 2/20 0.41
▸ ACACB O00763 1/20 0.41
▸ ACACA Q13085 1/20 0.41
▸ TACR3 P29371 1/20 0.40

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
SCHEMBL21818705 0.89 MGLL (0.56) P2RX7MGLL
SCHEMBL31133350 0.82 P2RX7 (0.55) P2RX7MGLLKCNH2ACACBACACA
SCHEMBL21818754 0.82 P2RX7 (0.55) P2RX7MGLLKCNH2ACACBACACA
SCHEMBL23872204 0.81 P2RX7 (0.47) P2RX7MGLLACACBACACA
SCHEMBL21894047 0.81 P2RX7 (0.49) P2RX7MGLL
SCHEMBL31133335 0.81 P2RX7 (0.61) P2RX7MGAMPRLHRMTHFD2
SCHEMBL21818671 0.81 P2RX7 (0.61) P2RX7MGAMPRLHRMTHFD2
SCHEMBL21818575 0.80 P2RX7 (0.56) P2RX7MTHFD2
SCHEMBL21819471 0.80 P2RX7 (0.55) P2RX7MGLLMTHFD2ACACBACACA
SCHEMBL21818779 0.80 P2RX7 (0.55) P2RX7MTHFD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 — — US claimed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 — — US claimed
EP-3856178-A1 MONOACYLGLYCEROL LIPASE MODULATORS Janssen Pharmaceutica NV (BE) 2021-08-04 — — EP claimed
WO-2020065613-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-04-02 — — WO claimed
US-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 — — US disclosed
EP-3856178-B1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2026-03-11 — — EP disclosed
CN-113164459-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-03 — — CN disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 — — US disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 — — US disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 — — US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 — — US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 — — US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 — — US disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 — — US disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 — — US disclosed
WO-2020065613-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-04-02 — — WO disclosed
US-20200102303-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2020-04-02 — — 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-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP P2RX7 1930/4885MGLL 1/4885DPP4 1174/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH P2RX7 1686/4885MGLL 1/4885DPP4 848/4885
US-20200102303-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP P2RX7 1930/4885MGLL 1/4885DPP4 1174/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP P2RX7 1930/4885MGLL 1/4885DPP4 1174/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP P2RX7 1930/4885MGLL 1/4885DPP4 1174/4885

“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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