SCHEMBL2266546

SCHEMBL2266546

NC(=O)Cc1cc(F)cc2ccoc12

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ICMT O60725 6/20 0.37
CFD P00746 6/20 0.35
XDH P47989 1/20 0.33
SLC22A12 Q96S37 1/20 0.33
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL2261369 0.79 PLA2G10 (0.43) CFDSLC22A12KDM4EPOLBMAPT
SCHEMBL5987073 0.78 PKM (0.41) KDM4EPOLBMAPTNPSR1HTT
SCHEMBL24656366 0.78 CYP3A4 (0.36) KDM4EPOLBMAPTHSD17B10GAA
Oxalic Acid SCHEMBL5987436 0.77 MEN1 (0.36) CFDXDHSLC22A12KDM4EMAPT
SCHEMBL2260036 0.77 EED (0.43) CFDGAANPSR1
SCHEMBL2265198 0.75 MAP2K1 (0.34) CFDXDHSLC22A12KDM4EPOLB
SCHEMBL5987860 0.75 IAPP (0.41) XDHSLC22A12KDM4EPOLBMAPT
SCHEMBL2262537 0.75 ICMT (0.35) ICMTCFD
SCHEMBL5987440 0.75 DPP4 (0.33) CFDXDHSLC22A12KDM4EPOLB
SCHEMBL30367823 0.75 PARP1 (0.43) XDHSLC22A12KDM4EPOLBMAPT

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
US-20110294792-A1 PURINE DERIVATIVES AS KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2011-12-01 US disclosed
US-8022065-B2 Purine derivatives as kinase inhibitors ELI LILLY AND COMPANY (US) 2011-09-20 US disclosed
US-20110207721-A1 PURINE DERIVATIVES AS KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2011-08-25 US disclosed
US-20090105229-A1 PURINE DERIVATIVES AS KINASE INHIBITORS ELI LILLY AND COMPANY 2009-04-23 US disclosed
EP-1487822-B1 PYRROLE-2,5-DIONE DERIVATIVES AND THEIR USE AS GSK-3 INHIBITORS LILLY CO ELI (US) 2007-08-01 EP disclosed
EP-1483265-B1 PURINE DERIVATIVES AS KINASE INHIBITORS LILLY CO ELI (US) 2006-11-22 EP disclosed
CN-1639152-A Pyrrole-2, 5-dione derivatives and their use as GSK-3 inhibitors LILLY CO ELI (US) 2005-07-13 CN 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 (3 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-20110294792-A1 PURINE DERIVATIVES AS KINASE INHIBITORS PNP, ADK, NME2 ICMT 4081/4885CFD 4563/4885XDH 346/4885
US-20110207721-A1 PURINE DERIVATIVES AS KINASE INHIBITORS PNP, ADK, NME2 ICMT 4081/4885CFD 4563/4885XDH 346/4885
US-20090105229-A1 PURINE DERIVATIVES AS KINASE INHIBITORS PNP, ADK, NME2 ICMT 4081/4885CFD 4563/4885XDH 346/4885

“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.