SCHEMBL16292007

SCHEMBL16292007

O[C@H]1CCC[C@@H](Oc2ccc(I)cc2)C1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FURIN P09958 3/20 0.49
PARP10 Q53GL7 1/20 0.44
EPHX2 P34913 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
ACACB O00763 2/20 0.35
CHEK2 O96017 1/20 0.35
PDK2 Q15119 1/20 0.34
SLC6A2 P23975 3/20 0.33
SLC6A4 P31645 3/20 0.33
SLC6A3 Q01959 3/20 0.33
FFAR4 Q5NUL3 5/20 0.33

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
SCHEMBL16291678 1.00 FURIN (0.49) FURINPARP10EPHX2ALDH1A1TSHR
SCHEMBL16292008 1.00 FURIN (0.49) FURINPARP10EPHX2ALDH1A1TSHR
SCHEMBL16308651 1.00 FURIN (0.49) FURINPARP10EPHX2ALDH1A1TSHR
SCHEMBL20217186 1.00 FURIN (0.49) FURINPARP10EPHX2ALDH1A1TSHR
SCHEMBL256373 0.83 PARP10 (0.53) FURINPARP10EPHX2ALDH1A1TSHR
SCHEMBL20217187 0.83 FURIN (0.49) FURINPARP10EPHX2ALDH1A1TSHR
SCHEMBL19921733 0.83 FURIN (0.49) FURINPARP10EPHX2FFAR4
SCHEMBL6575789 0.80 FURIN (0.46) FURINPARP10EPHX2CHEK2SLC6A2
SCHEMBL5375836 0.80 FURIN (0.46) FURINPARP10EPHX2CHEK2SLC6A2
SCHEMBL5383373 0.80 FURIN (0.46) FURINPARP10EPHX2CHEK2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2766352-B1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIV HEALTH NETWORK UHN (CA) 2018-06-06 EP disclosed
US-9580390-B2 Indazole compounds as kinase inhibitors and method of treating cancer with same UNIVERSITY HEALTH NETWORK (CA) 2017-02-28 US disclosed
US-20140371202-A1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERSITY HEALTH NETWORK (CA) 2014-12-18 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-20140371202-A1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME PLK4, PLK2, PLK3 FURIN 4451/4885PARP10 1870/4885EPHX2 4770/4885

“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.