SCHEMBL14873458

SCHEMBL14873458

O=C(N[C@@H](c1ccccn1)C1CC1)c1ccc2[nH]nc(-c3ccc(N4CC(N5CCOCC5)C4)cc3)c2c1

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TTK P33981 13/20 0.73
CYP3A4 P08684 11/20 0.73
AURKB Q96GD4 10/20 0.73
INCENP Q9NQS7 10/20 0.73
FGFR1 P11362 1/20 0.43
DDR2 Q16832 1/20 0.43
FLT3 P36888 4/20 0.42
ROCK1 Q13464 1/20 0.41

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
SCHEMBL16292275 1.00 TTK (0.73) TTKCYP3A4AURKBINCENPFGFR1
SCHEMBL16292500 0.97 TTK (0.74) TTKCYP3A4AURKBINCENPFGFR1
SCHEMBL16292499 0.97 TTK (0.74) TTKCYP3A4AURKBINCENPFGFR1
SCHEMBL16292181 0.92 TTK (0.77) TTKCYP3A4AURKBINCENPFLT3
SCHEMBL14873316 0.90 TTK (0.81) TTKCYP3A4AURKBINCENPFGFR1
SCHEMBL16293120 0.90 TTK (0.81) TTKCYP3A4AURKBINCENPFGFR1
SCHEMBL16292401 0.89 TTK (0.79) TTKCYP3A4AURKBINCENP
SCHEMBL16292402 0.89 TTK (0.79) TTKCYP3A4AURKBINCENP
SCHEMBL16308724 0.87 TTK (0.61) TTKCYP3A4AURKBINCENPFGFR1
SCHEMBL18559382 0.87 TTK (0.61) TTKCYP3A4AURKBINCENPFGFR1

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
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
WO-2013053051-A1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERSITY HEALTH NETWORK (CA) 2013-04-18 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 (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 TTK 7/4885CYP3A4 1012/4885AURKB 9/4885

“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.