SCHEMBL9985149

SCHEMBL9985149

CC(C)(C)c1ccc(C(=O)Nc2cc(-c3cc(Nc4ccncn4)c(=O)[nH]n3)ccc2F)cn1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BTK Q06187 3/20 0.43
MPL P40238 12/20 0.41
CLK1 P49759 2/20 0.40
CLK2 P49760 2/20 0.40
ITK Q08881 2/20 0.38
KIT P10721 1/20 0.38
SRC P12931 1/20 0.38
FLT3 P36888 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL2459218 0.90 KIT (0.48) BTKMPLITKKITSRC
SCHEMBL2461976 0.89 BTK (0.50) BTKMPLFLT3
SCHEMBL2466471 0.85 BTK (0.45) BTKMPLITKKITSRC
SCHEMBL2464530 0.82 MPL (0.43) BTKMPLITKKITSRC
SCHEMBL13363418 0.80 BTK (0.38) BTKMPL
SCHEMBL2492909 0.79 BTK (0.49) BTKCLK1CLK2SRCMEN1
SCHEMBL2462052 0.78 BTK (0.64) BTKMPLSRC
SCHEMBL19981736 0.78 BTK (0.39) BTKMPL
SCHEMBL19981663 0.78 BTK (0.41) BTKMPLSRC
SCHEMBL9985496 0.77 BTK (0.48) BTKITKKITSRCFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8598174-B2 Pyridazinones, method of making, and method of use thereof GENETECH, INC. (US) 2013-12-03 US claimed
EP-2365970-B1 PYRIDAZINONES AND THEIR USE AS BTK INHIBITORS GILEAD CONNECTICUT INC (US) 2018-03-21 EP disclosed
EP-2365970-B1 PYRIDAZINONES AND THEIR USE AS BTK INHIBITORS GILEAD CONNECTICUT INC (US) 2018-03-21 EP disclosed
US-8598174-B2 Pyridazinones, method of making, and method of use thereof GENETECH, INC. (US) 2013-12-03 US disclosed
US-20110301145-A1 PYRIDAZINONES, METHOD OF MAKING, AND METHOD OF USE THEREOF Gilead Connecticut INc. (US) 2011-12-08 US disclosed
US-20110301145-A1 PYRIDAZINONES, METHOD OF MAKING, AND METHOD OF USE THEREOF Gilead Connecticut INc. (US) 2011-12-08 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 (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-20110301145-A1 PYRIDAZINONES, METHOD OF MAKING, AND METHOD OF USE THEREOF BTK, SYK, LCK BTK 1/4885MPL 28/4885CLK1 1632/4885

“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.