SCHEMBL3272822

SCHEMBL3272822

O=C(O)c1nccc2cn[nH]c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 1/20 0.44
CHEK1 O14757 1/20 0.44
AURKA O14965 1/20 0.44
DAPK3 O43293 1/20 0.44
MAP4K4 O95819 1/20 0.44
CSF1R P07333 1/20 0.44
RET P07949 1/20 0.44
FGFR1 P11362 1/20 0.44
PDGFRA P16234 1/20 0.44
LTK P29376 1/20 0.44
KDR P35968 1/20 0.44
MAP2K2 P36507 1/20 0.44
FLT3 P36888 1/20 0.44
CSNK1A1 P48729 1/20 0.44
PRKX P51817 1/20 0.44
CDK5 Q00535 1/20 0.44
MAP2K1 Q02750 1/20 0.44
MST1R Q04912 1/20 0.44
PTK2 Q05397 1/20 0.44
BTK Q06187 1/20 0.44

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
SCHEMBL29696517 1.00 PLK4 (0.44) PLK4CHEK1AURKADAPK3MAP4K4
SCHEMBL35211342 0.84 ROCK1 (0.42) PLK4CHEK1AURKADAPK3MAP4K4
SCHEMBL29494919 0.84 BTK (0.54) PLK4CHEK1AURKADAPK3MAP4K4
SCHEMBL1154955 0.73 NOS1 (0.42) PLK4CHEK1AURKADAPK3MAP4K4
SCHEMBL29696589 0.73 GRM5 (0.56) KDM4EASPHKDM8MAPTCYP3A4
SCHEMBL3276660 0.73 GRM5 (0.56) KDM4EASPHKDM8MAPTCYP3A4
SCHEMBL31178673 0.71 METTL3 (0.45) KDM4EASPHKDM8MAPTCYP3A4
SCHEMBL17159727 0.71 METTL3 (0.45) KDM4EASPHKDM8MAPTCYP3A4
SCHEMBL22715810 0.70 NOS1 (0.37) PLK4CHEK1AURKADAPK3MAP4K4
SCHEMBL12480129 0.69 MAPT (0.48) PLK4CHEK1AURKADAPK3MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1984364-A1 HETEROBICYCLIC AMIDE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-10-29 EP claimed
WO-2007090751-A1 HETEROBICYCLIC AMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-08-16 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
WO-2025049746-A1 COMPOSITIONS COMPRISING WERNER SYNDROME HELICASE INHIBITORS AND METHODS OF USING THE SAME EIKON THERAPEUTICS, INC. (US) 2025-03-06 WO disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-20230286978-A1 INDAZOLE DERIVATIVES AS INHIBITORS OF SARM1 DISARM THERAPEUTICS, INC. 2023-09-14 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
EP-3856178-A1 MONOACYLGLYCEROL LIPASE MODULATORS Janssen Pharmaceutica NV (BE) 2021-08-04 EP disclosed
CN-113164459-A Monoacylglycerol lipase modulators 詹森药业有限公司 2021-07-23 CN 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
US-7691876-B2 Heterobicyclic amide compounds HOFFMANN-LA ROCHE INC. (US) 2010-04-06 US disclosed
EP-1984364-A1 HETEROBICYCLIC AMIDE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-10-29 EP disclosed
WO-2007090751-A1 HETEROBICYCLIC AMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-08-16 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-20230286978-A1 INDAZOLE DERIVATIVES AS INHIBITORS OF SARM1 SARM1, SMN1; SMN2, AIFM1 PLK4 2857/4885CHEK1 1329/4885AURKA 4356/4885
US-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP PLK4 2449/4885CHEK1 2337/4885AURKA 3364/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH PLK4 3458/4885CHEK1 2323/4885AURKA 4623/4885
US-20200102303-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP PLK4 2449/4885CHEK1 2337/4885AURKA 3364/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP PLK4 2449/4885CHEK1 2337/4885AURKA 3364/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP PLK4 2449/4885CHEK1 2337/4885AURKA 3364/4885

“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.