SCHEMBL657295

SCHEMBL657295

Brc1csc2cncnc12

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 8/20 0.37
AURKA O14965 1/20 0.31
MAP3K7 O43318 1/20 0.31
FLT3 P36888 1/20 0.31
SYK P43405 1/20 0.31
ACVR1 Q04771 1/20 0.30
HDAC8 Q9BY41 1/20 0.30

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
SCHEMBL30679394 1.00 IRAK4 (0.37) IRAK4AURKAMAP3K7FLT3SYK
SCHEMBL21371622 0.78 IRAK4 (0.37) IRAK4AURKAMAP3K7FLT3SYK
SCHEMBL4302108 0.77 IRAK4 (0.39) IRAK4AURKAMAP3K7FLT3SYK
SCHEMBL360516 0.77 IRAK4 (0.39) IRAK4AURKAMAP3K7FLT3SYK
SCHEMBL29936180 0.77 IRAK4 (0.39) IRAK4AURKAMAP3K7FLT3SYK
SCHEMBL20594478 0.76 IRAK4 (0.34) IRAK4
SCHEMBL24375572 0.72 IRAK4 (0.39) IRAK4AURKAMAP3K7FLT3SYK
SCHEMBL22430212 0.72 IRAK4 (0.36) IRAK4AURKAMAP3K7FLT3SYK
SCHEMBL12162964 0.72 IRAK4 (0.34) IRAK4
SCHEMBL15067257 0.72 CYP2A6 (0.40) IRAK4AURKAMAP3K7FLT3SYK

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
US-20240190855-A1 CDK INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2024-06-13 US disclosed
EP-4291176-A1 CDK INHIBITORS AND METHODS OF USE THEREOF Relay Therapeutics, Inc. (US) 2023-12-20 EP disclosed
WO-2015076600-A1 NOVEL LIGHT EMISSION COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 동진쎄미켐 2015-05-28 WO disclosed
US-8378104-B2 7-aminofuropyridine derivatives OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
US-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 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-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES MAP3K5, STK17A, MAPKAPK5 IRAK4 63/4885AURKA 129/4885MAP3K7 5/4885
US-20240190855-A1 CDK INHIBITORS AND METHODS OF USE THEREOF CDK3, CDK8, CDK6 IRAK4 2357/4885AURKA 172/4885MAP3K7 86/4885

“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.