SCHEMBL2566478

SCHEMBL2566478

Cc1ccccc1CC(=O)Nc1ccc2[nH]nc(I)c2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 3/20 0.62
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ TDP1 Q9NUW8 1/20 0.51
▸ AURKA O14965 1/20 0.51
▸ HAO1 Q9UJM8 2/20 0.47
▸ CDK2 P24941 1/20 0.47
▸ ANO1 Q5XXA6 1/20 0.47
▸ NPC1 O15118 2/20 0.46
▸ AKR1B1 P15121 1/20 0.46
▸ P2RY14 Q15391 1/20 0.44
▸ ROCK2 O75116 1/20 0.44
▸ ITK Q08881 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ CLK2 P49760 1/20 0.43
▸ PRKX P51817 1/20 0.43
▸ CAMK2D Q13557 1/20 0.43
▸ PKN2 Q16513 1/20 0.43
▸ CLK4 Q9HAZ1 1/20 0.43
▸ STK17A Q9UEE5 1/20 0.43

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
SCHEMBL12907318 0.87 TTK (0.66) TTKMEN1KMT2ATDP1AURKA
SCHEMBL12282261 0.78 TTK (0.85) TTKAURKA
SCHEMBL14863599 0.77 JAK2 (0.51) TTKAURKAHAO1ITKJAK2
SCHEMBL2557544 0.77 TTK (0.63) TTKMEN1KMT2AAURKANPC1
SCHEMBL2564968 0.77 TTK (1.00) TTKAURKA
SCHEMBL2564735 0.76 ITK (0.55) TTKKMT2AROCK2ITKJAK2
SCHEMBL12323598 0.75 KMT2A (0.67) MEN1KMT2ATDP1ANO1NPC1
SCHEMBL758975 0.74 ROCK2 (0.61) AURKAHAO1ROCK2ITKPRKX
SCHEMBL12281699 0.74 TTK (0.67) TTKAURKAITK
SCHEMBL12907286 0.74 JAK2 (0.66) TTKAURKACDK2ROCK2CLK2

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 5 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
US-20140051679-A1 KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERISTY HEALTH NETWORKS (CA) 2014-02-20 — — US disclosed
WO-2011123937-A1 KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERSITY HEALTH NETWORK (CA) 2011-10-13 — — 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 (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-20140371202-A1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME PLK4, PLK2, PLK3 TTK 7/4885MEN1 2669/4885KMT2A 1936/4885
US-20140051679-A1 KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME MAP3K7, MAP3K1, MAP3K20 TTK 73/4885MEN1 1067/4885KMT2A 579/4885

“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.

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