SCHEMBL15664399

SCHEMBL15664399

O=C(C1CCCCC1)N1CCN(c2ncnc3[nH]ccc23)CC1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 7/20 0.62
KIT P10721 6/20 0.61
AKT2 P31751 2/20 0.58
GSK3B P49841 2/20 0.58
LCK P06239 1/20 0.57
HTR2C P28335 1/20 0.54
DOT1L Q8TEK3 1/20 0.54
AKT1 P31749 2/20 0.53
JAK1 P23458 1/20 0.53

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
SCHEMBL15664177 0.99 KIT (0.63) JAK3KITAKT2GSK3BLCK
SCHEMBL15988537 0.86 JAK3 (0.58) JAK3KITLCKAKT1JAK1
SCHEMBL15664487 0.84 KIT (0.61) JAK3KITAKT2GSK3BLCK
SCHEMBL15664162 0.83 KIT (0.62) JAK3KITAKT2GSK3BLCK
SCHEMBL15664424 0.82 JAK3 (0.60) JAK3KITAKT2GSK3BLCK
SCHEMBL30976737 0.81 KIT (0.71) JAK3KITAKT2GSK3BLCK
SCHEMBL15663627 0.81 KIT (0.60) JAK3KITAKT2GSK3BLCK
SCHEMBL22645626 0.79 AKT2 (0.69) JAK3KITAKT2GSK3BLCK
SCHEMBL30056647 0.79 AKT2 (0.69) JAK3KITAKT2GSK3BLCK
SCHEMBL27460388 0.79 AKT2 (0.69) JAK3KITAKT2GSK3BLCK

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-2892534-B1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2021-08-04 EP disclosed
US-10227357-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2019-03-12 US disclosed
US-10227357-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2019-03-12 US disclosed
US-20140128390-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2014-05-08 US disclosed
US-20140128390-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2014-05-08 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 (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-10227357-B2 Compounds and methods for kinase modulation, and indications therefor KIT, PRKCH, PRKACA JAK3 148/4885KIT 1/4885AKT2 72/4885
US-20140128390-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR KIT, PRKCH, PRKACA JAK3 148/4885KIT 1/4885AKT2 72/4885

“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.