SCHEMBL29569628

SCHEMBL29569628

Cn1ncc2cc(C=O)ccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.54
MAOB P27338 3/20 0.52
CLK1 P49759 5/20 0.44
DYRK1A Q13627 5/20 0.44
CLK4 Q9HAZ1 5/20 0.44
DYRK1B Q9Y463 5/20 0.44
DYRK3 O43781 3/20 0.44
CLK3 P49761 3/20 0.44
DYRK2 Q92630 3/20 0.44
DYRK4 Q9NR20 2/20 0.44
CLK2 P49760 2/20 0.44
ESR1 P03372 1/20 0.43
TRPA1 O75762 1/20 0.42
CCNC P24863 1/20 0.41
CDK8 P49336 1/20 0.41
MAOA P21397 1/20 0.41
ACHE P22303 1/20 0.41
CTNNB1 P35222 1/20 0.40
TCF7 P36402 1/20 0.40
CDC7 O00311 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
SCHEMBL1163509 1.00 CYP2A6 (0.54) CYP2A6MAOBCLK1DYRK1ACLK4
SCHEMBL2138250 0.86 CYP2A6 (0.54) CYP2A6MAOBESR1CCNCCDK8
SCHEMBL29570479 0.86 CYP2A6 (0.54) CYP2A6MAOBESR1CCNCCDK8
SCHEMBL18911976 0.82 MAOB (0.52) MAOBCLK1DYRK1ACLK4DYRK1B
SCHEMBL23497966 0.79 CYP2A6 (0.47) CYP2A6MAOBMAOAPDE1C
SCHEMBL30044048 0.79 CYP2A6 (0.47) CYP2A6MAOBMAOAPDE1C
SCHEMBL28167573 0.79 CYP2A6 (0.46) CYP2A6MAOBALDH1A1RAB9A
SCHEMBL13726686 0.79 CYP2A6 (0.46) CYP2A6MAOBCLK1DYRK1ACLK4
SCHEMBL3436601 0.78 CYP2A6 (0.46) CYP2A6MAOBALDH1A1
SCHEMBL27688161 0.78 CYP2A6 (0.46) CYP2A6MAOB

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-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 US disclosed
EP-4665718-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF Apogee Pharmaceuticals, Inc. (CA) 2025-12-24 EP disclosed
EP-4558511-A2 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF Firefly Bio, Inc. (US) 2025-05-28 EP disclosed
WO-2025040167-A1 PHOSPHOINOSITIDE 3-KINASE ALLOSTERIC INHIBITOR FOR TREATING DISEASE RELATED TO PI3K REGULATION 上海艾力斯医药科技股份有限公司 2025-02-27 WO disclosed
EP-4499649-A1 IKZF2 DEGRADERS AND USES THEREOF Regents of the University of Michigan (US) 2025-02-05 EP disclosed
WO-2024168426-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF APOGEE PHARMACEUTICALS, INC. (CA) 2024-08-22 WO disclosed
US-11958837-B2 Quinazolinones as PARP14 inhibitors RIBON THERAPEUTICS, INC. (US) 2024-04-16 US disclosed
WO-2024020164-A2 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF FIREFLY BIO, INC. (US) 2024-01-25 WO disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
WO-2023183540-A1 IKZF2 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2023-09-28 WO disclosed
EP-4225745-A1 ACETAMIDO-PHENYLBENZAMIDE DERIVATIVES AND METHODS OF USING THE SAME Athenex, Inc. (US) 2023-08-16 EP disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 US disclosed
US-20230018702-A1 QUINAZOLINONES AS PARP14 INHIBITORS ABBVIE BIOTECHNOLOGY LTD (BM) 2023-01-19 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 US disclosed
EP-4073054-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF TUMORS Fondazione Istituto Italiano di Tecnologia (IT) 2022-10-19 EP disclosed
WO-2022076662-A1 ACETAMIDO-PHENYLBENZAMIDE DERIVATIVES AND METHODS OF USING THE SAME ATHENEX, INC. (US) 2022-04-14 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 (6 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 CYP2A6 747/4885MAOB 225/4885CLK1 1650/4885
US-11958837-B2 Quinazolinones as PARP14 inhibitors PARP14, PARP15, PARP11 CYP2A6 3772/4885MAOB 3464/4885CLK1 1242/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH CYP2A6 555/4885MAOB 165/4885CLK1 1569/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP CYP2A6 747/4885MAOB 225/4885CLK1 1650/4885
US-20230018702-A1 QUINAZOLINONES AS PARP14 INHIBITORS PARP14, PARP15, PARP11 CYP2A6 3772/4885MAOB 3464/4885CLK1 1242/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP CYP2A6 747/4885MAOB 225/4885CLK1 1650/4885

“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.