SCHEMBL1049720

SCHEMBL1049720

O=c1[nH]ccc2cc(-c3cncnc3)nc(Nc3ccc(C4CCNCC4)c(C(F)(F)F)c3)c12

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 14/20 0.61
LRRK2 Q5S007 1/20 0.37
APP P05067 1/20 0.37
CSF1R P07333 1/20 0.37
CDK4 P11802 1/20 0.37
CDK6 Q00534 1/20 0.37
KIT P10721 1/20 0.36
FLT3 P36888 1/20 0.36
SYK P43405 1/20 0.36
FER P16591 1/20 0.36

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
SCHEMBL1048561 0.90 ZAP70 (0.73) ZAP70LRRK2SYK
SCHEMBL6523277 0.89 ZAP70 (0.64) ZAP70APPSYKFER
SCHEMBL1045741 0.88 ZAP70 (0.50) ZAP70APPCSF1RCDK4CDK6
SCHEMBL1047719 0.88 ZAP70 (0.51) ZAP70LRRK2APPCSF1RCDK4
SCHEMBL1047921 0.87 ZAP70 (0.79) ZAP70SYKFER
SCHEMBL1047246 0.83 ZAP70 (0.55) ZAP70LRRK2CSF1R
SCHEMBL1045557 0.79 ZAP70 (0.61) ZAP70LRRK2
SCHEMBL3363322 0.79 ZAP70 (0.38) ZAP70APPCSF1RCDK4CDK6
SCHEMBL1158377 0.79 ZAP70 (0.60) ZAP70SYKFER
SCHEMBL1047542 0.79 ZAP70 (0.58) ZAP70LRRK2SYK

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US claimed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US claimed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 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-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FYN, SYK, RET ZAP70 4/4885LRRK2 517/4885APP 2075/4885

“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.