SCHEMBL130504

SCHEMBL130504

CNc1nc(Cl)nc2[nH]ncc12

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 2/20 0.57
PAK4 O96013 2/20 0.57
PDPK1 O15530 1/20 0.53
PDE2A O00408 2/20 0.47
XDH P47989 1/20 0.45
HTR2C P28335 5/20 0.44
YTHDC1 Q96MU7 2/20 0.42
HTR2A P28223 4/20 0.40
MKNK1 Q9BUB5 1/20 0.37
BTK Q06187 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34

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
SCHEMBL8095697 0.83 PLK4 (0.55) PLK4PAK4PDPK1PDE2AXDH
SCHEMBL24672488 0.82 PLK4 (0.58) PLK4PAK4PDPK1PDE2AHTR2C
SCHEMBL30861057 0.81 PLK4 (0.54) PLK4PAK4PDPK1PDE2AHTR2C
SCHEMBL27227932 0.81 PLK4 (0.54) PLK4PAK4PDPK1PDE2AHTR2C
SCHEMBL13828306 0.79 HTR2C (0.65) PLK4PAK4PDPK1HTR2CHTR2A
SCHEMBL14441306 0.79 PDPK1 (0.55) PLK4PAK4PDPK1HTR2CHTR2A
SCHEMBL22282188 0.78 ALDH1A1 (0.59) PLK4PAK4PDE2AHTR2CHTR2A
SCHEMBL130797 0.78 PDPK1 (0.53) PLK4PAK4PDPK1HTR2CHTR2A
SCHEMBL31706902 0.78 PDPK1 (0.58) PLK4PAK4PDPK1XDHHTR2C
SCHEMBL130812 0.78 PDPK1 (0.53) PLK4PAK4PDPK1HTR2CHTR2A

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3778604-B1 LRRK2 INHIBITORS AND METHODS OF MAKING AND USING THE SAME DANA FARBER CANCER INST INC (US) 2026-01-07 EP disclosed
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. 2024-05-30 US disclosed
WO-2024073073-A2 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. (US) 2024-04-04 WO disclosed
US-11858907-B2 Kinase modulators RHIZEN PHARMACEUTICALS AG (CH) 2024-01-02 US disclosed
US-20210401840-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS AG (CH) 2021-12-30 US disclosed
CN-113563342-A LRRK2 inhibitors and methods of making and using the same 达纳-法伯癌症研究所公司 2021-10-29 CN disclosed
CN-107801397-B LRRK2 inhibitors and methods of making and using the same 达纳-法伯癌症研究所公司 2021-07-30 CN disclosed
US-20210115055-A1 LRRK2 INHIBITORS AND METHODS OF MAKING AND USING THE SAME DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-04-22 US disclosed
US-20210115055-A1 LRRK2 INHIBITORS AND METHODS OF MAKING AND USING THE SAME DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-04-22 US disclosed
EP-3778604-A1 LRRK2 INHIBITORS AND METHODS OF MAKING AND USING THE SAME Dana Farber Cancer Institute, Inc. (US) 2021-02-17 EP disclosed
US-20150320752-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS AG (CH) 2015-11-12 US disclosed
US-20150174131-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS AG (CH) 2015-06-25 US disclosed
US-20150174131-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS AG (CH) 2015-06-25 US disclosed
US-9018375-B2 Substituted chromenes as kinase modulators RHIZEN PHARMACEUTICALS SA (CH) 2015-04-28 US disclosed
US-20140080827-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS SA (CH) 2014-03-20 US disclosed
US-8642607-B2 4H-chromen-4-one compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2014-02-04 US disclosed
US-8642607-B2 4H-chromen-4-one compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2014-02-04 US disclosed
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2012-11-15 US disclosed
US-20120059001-A1 NOVEL KINASE MODULATORS INCOZEN THERAPEUTICS PVT. LTD. (IN) 2012-03-08 US disclosed
US-20110118257-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS SA (CH) 2011-05-19 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 (10 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-20210401840-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PLK4 333/4885PAK4 225/4885PDPK1 9/4885
US-20150174131-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB PLK4 433/4885PAK4 267/4885PDPK1 30/4885
US-20210115055-A1 LRRK2 INHIBITORS AND METHODS OF MAKING AND USING THE SAME LRRK2, PARK7, PINK1 PLK4 1770/4885PAK4 213/4885PDPK1 26/4885
US-20150320752-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PLK4 333/4885PAK4 225/4885PDPK1 9/4885
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PLK4 333/4885PAK4 225/4885PDPK1 9/4885
US-20140080827-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB PLK4 433/4885PAK4 267/4885PDPK1 30/4885
US-20110118257-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB PLK4 433/4885PAK4 267/4885PDPK1 30/4885
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF LRRK2, MAP3K20, MAP3K5 PLK4 399/4885PAK4 142/4885PDPK1 42/4885
US-11858907-B2 Kinase modulators RPS6KA1, RPS6KA2, PRKAR2A PLK4 595/4885PAK4 537/4885PDPK1 65/4885
US-20120059001-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB PLK4 433/4885PAK4 267/4885PDPK1 30/4885

“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.