SCHEMBL15312439

SCHEMBL15312439

CC(C)(C)OC(=O)N1CCC(c2ccc3[nH]nc(-c4cn(-c5ccc(C(=O)N6CCOCC6)cc5)nn4)c3c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.43
LMNA P02545 1/20 0.42
GRM1 Q13255 4/20 0.41
GPR119 Q8TDV5 6/20 0.40
GRM5 P41594 3/20 0.40
JAK2 O60674 1/20 0.40
LRRK2 Q5S007 2/20 0.39
TLR9 Q9NR96 1/20 0.38
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 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
Hydrochloric Acid SCHEMBL9951746 0.99 FLT3 (0.42) FLT3LMNAGRM1GPR119GRM5
SCHEMBL10194972 0.90 FLT3 (0.46) FLT3JAK2LRRK2TLR9TLR8
SCHEMBL10194806 0.89 FLT3 (0.45) FLT3JAK2LRRK2TLR9TLR8
SCHEMBL9952698 0.88 FLT3 (0.41) FLT3LMNAGRM1GPR119GRM5
SCHEMBL10194863 0.86 FLT3 (0.49) FLT3JAK2LRRK2
Hydrochloric Acid SCHEMBL9951818 0.86 FLT3 (0.48) FLT3JAK2LRRK2
SCHEMBL10194739 0.85 FLT3 (0.43) FLT3JAK2LRRK2TLR9TLR8
SCHEMBL10196691 0.84 FLT3 (0.43) FLT3JAK2LRRK2TLR9TLR8
SCHEMBL9951834 0.83 GRM1 (0.50) GRM1GPR119GRM5
SCHEMBL10194925 0.83 FLT3 (0.47) FLT3JAK2LRRK2

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 7 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-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
US-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES MERCK SERONO S.A. - INTELLECTUAL PROPERTY (CH) 2013-10-17 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-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES NFATC1, IL5, CD4 FLT3 282/4885LMNA 4562/4885GRM1 3003/4885

“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.