SCHEMBL4302108

SCHEMBL4302108

Clc1csc2cncnc12

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 15/20 0.39
IRAK1 P51617 3/20 0.33
CYP17A1 P05093 1/20 0.32
AURKA O14965 1/20 0.30
MAP3K7 O43318 1/20 0.30
FLT3 P36888 1/20 0.30
SYK P43405 1/20 0.30
ACVR1 Q04771 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
SCHEMBL657295 0.77 IRAK4 (0.37) IRAK4AURKAMAP3K7FLT3SYK
SCHEMBL30679394 0.77 IRAK4 (0.37) IRAK4AURKAMAP3K7FLT3SYK
SCHEMBL21371622 0.77 IRAK4 (0.37) IRAK4IRAK1CYP17A1AURKAMAP3K7
SCHEMBL360516 0.75 IRAK4 (0.39) IRAK4CYP17A1AURKAMAP3K7FLT3
SCHEMBL29936180 0.75 IRAK4 (0.39) IRAK4CYP17A1AURKAMAP3K7FLT3
SCHEMBL29994731 0.73 IRAK4 (0.33) IRAK4IRAK1CYP17A1AURKAMAP3K7
SCHEMBL24375572 0.71 IRAK4 (0.39) IRAK4IRAK1AURKAMAP3K7FLT3
SCHEMBL22430212 0.71 IRAK4 (0.36) IRAK4IRAK1AURKAMAP3K7FLT3
SCHEMBL12162964 0.71 IRAK4 (0.34) IRAK4
SCHEMBL20594478 0.71 IRAK4 (0.34) IRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2578590-B1 ANTI-INFLAMMATORY COMPOUND HAVING INHIBITORY ACTIVITY AGAINST MULTIPLE TYROSINE KINASES, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME KOREA INST SCI & TECH (KR) 2017-08-16 EP disclosed
CN-102971327-B There is the anti-inflammatory compound of multiple tyrosine-kinase enzyme inhibition activity and the pharmaceutical compositions containing these compounds KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-04-20 CN disclosed
US-9062066-B2 Anti-inflammatory compound having inhibitory activity against multiple tyrosine kinases and pharmaceutical composition containing same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-06-23 US disclosed
EP-2578590-A2 ANTI-INFLAMMATORY COMPOUND HAVING INHIBITORY ACTIVITY AGAINST MULTIPLE TYROSINE KINASES, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Korea Institute of Science and Technology (KR) 2013-04-10 EP disclosed
US-20130072482-A1 ANTI-INFLAMMATORY COMPOUND HAVING INHIBITORY ACTIVITY AGAINST MULTIPLE TYROSINE KINASES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME PHAROSBIOMED CO., LTD. (KR) 2013-03-21 US disclosed
CN-102971327-A Anti-inflammatory compound having inhibitory activity against multiple tyrosine kinases, and pharmaceutical composition containing same KOREA INST SCI & TECH 2013-03-13 CN disclosed
US-20090270391-A1 THIENOPYRIDINE DERIVATIVE, OR QUINOLINE DERIVATIVE, OR QUINAZOLINE DERIVATIVE, HAVING c-MET AUTOPHOSPHORYLATION INHIBITING POTENCY KIRIN PHARMA KABUSHIKI KAISHA (JP) 2009-10-29 US disclosed
EP-1870414-A1 THIENOPYRIDINE DERIVATIVE, OR QUINOLINE DERIVATIVE, OR QUINAZOLINE DERIVATIVE, HAVING C-MET AUTOPHOSPHORYLATION INHIBITING POTENCY Kirin Pharma Kabushiki Kaisha (JP) 2007-12-26 EP 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-20090270391-A1 THIENOPYRIDINE DERIVATIVE, OR QUINOLINE DERIVATIVE, OR QUINAZOLINE DERIVATIVE, HAVING c-MET AUTOPHOSPHORYLATION INHIBITING POTENCY MET, ABL1, RET IRAK4 347/4885IRAK1 393/4885CYP17A1 4348/4885
US-20130072482-A1 ANTI-INFLAMMATORY COMPOUND HAVING INHIBITORY ACTIVITY AGAINST MULTIPLE TYROSINE KINASES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME LCK, SRC, MAP3K1 IRAK4 47/4885IRAK1 32/4885CYP17A1 2354/4885

“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.