SCHEMBL10196822

SCHEMBL10196822

O=C(c1ccc2[nH]nc(-c3cn(-c4ccc(CN5CCOCC5)cc4)nn3)c2c1)N1CCC(c2ccncc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 5/20 0.46
STAT3 P40763 1/20 0.42
CCNC P24863 1/20 0.41
CDK8 P49336 1/20 0.41
HRH3 Q9Y5N1 3/20 0.40
GAA P10253 1/20 0.40
LMNA P02545 1/20 0.39
CHEK1 O14757 2/20 0.39
CDK7 P50613 2/20 0.39
HPGD P15428 1/20 0.39
MAPK14 Q16539 1/20 0.38

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
SCHEMBL10194976 0.88 FLT3 (0.47) FLT3STAT3HRH3GAACHEK1
SCHEMBL9952325 0.84 CHEK1 (0.46) FLT3CHEK1CDK7
SCHEMBL10194787 0.83 CHEK1 (0.57) FLT3STAT3CHEK1CDK7
SCHEMBL10194932 0.82 MAPK10 (0.45) FLT3STAT3GAACHEK1CDK7
SCHEMBL15317779 0.81 FLT3 (0.51) FLT3CHEK1CDK7
SCHEMBL10194719 0.81 FLT3 (0.51) FLT3CHEK1CDK7
SCHEMBL10194972 0.81 FLT3 (0.46) FLT3CCNCCDK8
SCHEMBL10194739 0.80 FLT3 (0.43) FLT3MAPK14
SCHEMBL10194806 0.80 FLT3 (0.45) FLT3CCNCCDK8
SCHEMBL10194698 0.79 MAPK10 (0.49) FLT3CCNCCDK8GAAHPGD

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
EP-2655357-B1 INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS MERCK SERONO SA (CH) 2016-06-22 EP disclosed
US-9073892-B2 Indazolyl triazol derivatives MERCK SERONO S.A. (CH) 2015-07-07 US disclosed
US-9073892-B2 Indazolyl triazol derivatives MERCK SERONO S.A. (CH) 2015-07-07 US disclosed
US-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES MERCK SERONO S.A. - INTELLECTUAL PROPERTY (CH) 2013-10-17 US disclosed
US-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES MERCK SERONO S.A. - INTELLECTUAL PROPERTY (CH) 2013-10-17 US disclosed
WO-2012084704-A1 INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS MERCK SERONO S.A. (CH) 2012-06-28 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-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES NFATC1, IL5, CD4 FLT3 282/4885STAT3 149/4885CCNC 4027/4885

“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.