SCHEMBL4079257

SCHEMBL4079257

CCON=Cc1ccc2[nH]nc(-c3ccc4cc(OCC(=O)N5[C@H](C)CCC[C@@H]5C)ccc4c3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TTK P33981 5/20 0.39
MAPK8 P45983 4/20 0.39
ALDH1A1 P00352 3/20 0.35
GAA P10253 1/20 0.35
LRRK2 Q5S007 4/20 0.35
TSHR P16473 1/20 0.35
SRC P12931 1/20 0.34
KCNH2 Q12809 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 1/20 0.34
FFAR4 Q5NUL3 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
SCHEMBL4175023 0.77 MAPK8 (0.35) TTKMAPK8ALDH1A1TSHRKCNH2
SCHEMBL4169058 0.77 TTK (0.35) TTKMAPK8ALDH1A1LRRK2TSHR
Hydrochloric Acid SCHEMBL5377501 0.71 MAP3K5 (0.51) TTKMAPK8LRRK2
Hydrochloric Acid SCHEMBL5386296 0.69 MAP3K5 (0.55) TTKMAPK8LRRK2
SCHEMBL4090234 0.68 TTK (0.39) TTKMAPK8LRRK2
SCHEMBL4084785 0.68 TTK (0.39) TTKMAPK8LRRK2
SCHEMBL4089498 0.67 HRH3 (0.41) TTKMAPK8KCNH2
SCHEMBL4083384 0.67 ALDH1A1 (0.57) ALDH1A1GAATSHRKMT2AKDM4E
SCHEMBL4079986 0.67 TTK (0.38) TTKMAPK8LRRK2
SCHEMBL4089562 0.66 HRH3 (0.40) TTKMAPK8KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 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 (1 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-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 TTK 401/4885MAPK8 213/4885ALDH1A1 3165/4885

“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.