SCHEMBL22264153

SCHEMBL22264153

COc1ccc(-c2n[nH]c3ccc(-c4ccn(Cc5ccnc(C(F)(F)F)c5)c(=O)c4)cc23)cn1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 4/20 0.41
MAPK1 P28482 3/20 0.40
NTRK1 P04629 1/20 0.40
DYRK1A Q13627 7/20 0.39
WNT1 P04628 6/20 0.39
CLK2 P49760 5/20 0.39
CLK3 P49761 5/20 0.39
TBK1 Q9UHD2 2/20 0.39
GSK3B P49841 2/20 0.36

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
SCHEMBL20786506 0.88 LRRK2 (0.42) LRRK2MAPK1DYRK1AWNT1CLK2
SCHEMBL20786572 0.86 DYRK1A (0.42) MAPK1DYRK1AWNT1CLK2CLK3
SCHEMBL20786113 0.85 MAPK1 (0.45) LRRK2MAPK1DYRK1AWNT1CLK2
SCHEMBL22277954 0.85 DYRK1A (0.43) LRRK2MAPK1DYRK1AWNT1CLK2
SCHEMBL22264165 0.85 AXL (0.50) LRRK2NTRK1DYRK1AWNT1GSK3B
SCHEMBL22264352 0.84 WNT1 (0.38) LRRK2MAPK1DYRK1AWNT1CLK2
SCHEMBL20786501 0.83 WNT1 (0.39) MAPK1NTRK1DYRK1AWNT1CLK2
SCHEMBL22264195 0.81 HDAC6 (0.47) LRRK2MAPK1DYRK1AWNT1CLK2
SCHEMBL20786346 0.78 MAPK1 (0.40) MAPK1
SCHEMBL20786026 0.77 MAPK1 (0.46) LRRK2MAPK1

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
US-11242334-B2 Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof JS INNOPHARM (SHANGHAI) LTD. (CN) 2022-02-08 US claimed
US-20200239438-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOPHARM (SHANGHAI) LTD (CN) 2020-07-30 US claimed
US-11242334-B2 Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof JS INNOPHARM (SHANGHAI) LTD. (CN) 2022-02-08 US disclosed
US-11242334-B2 Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof JS INNOPHARM (SHANGHAI) LTD. (CN) 2022-02-08 US disclosed
US-20200239438-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOPHARM (SHANGHAI) LTD (CN) 2020-07-30 US disclosed
US-20200239438-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOPHARM (SHANGHAI) LTD (CN) 2020-07-30 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 (2 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-20200239438-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF MAP3K20, MAP3K19, MAP3K1 LRRK2 635/4885MAPK1 40/4885NTRK1 706/4885
US-11242334-B2 Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof MAP3K20, MAP3K19, MAP3K1 LRRK2 635/4885MAPK1 40/4885NTRK1 706/4885

“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.