SCHEMBL2464995

SCHEMBL2464995

CN1CC(c2ccc(Nc3cc(-c4ccc(F)c(NC(=O)c5ccc(C(C)(C)C)cc5)c4)n[nH]c3=O)nc2)C1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BTK Q06187 11/20 0.48
SRC P12931 2/20 0.38
KIT P10721 1/20 0.38
FLT3 P36888 1/20 0.38
ITK Q08881 1/20 0.38
PPARG P37231 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
CLK2 P49760 1/20 0.37
MAPK14 Q16539 1/20 0.37
P2RX7 Q99572 1/20 0.36
TP53 P04637 1/20 0.36
DEGS1 O15121 1/20 0.35
HTR1F P30939 1/20 0.34
FGR P09769 1/20 0.34
TEC P42680 1/20 0.34
BMX P51813 1/20 0.34

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
SCHEMBL9985063 0.92 BTK (0.45) BTKSRCKITFLT3ITK
SCHEMBL9985469 0.88 BTK (0.47) BTKSRCKITFLT3ITK
SCHEMBL2461953 0.84 BTK (0.66) BTKSRCKITFGRTEC
SCHEMBL2459246 0.83 BTK (0.43) BTKSRCKITFLT3ITK
SCHEMBL9984842 0.82 BTK (0.44) BTKSRCKITFLT3ITK
SCHEMBL2459218 0.82 KIT (0.48) BTKSRCKITFLT3ITK
SCHEMBL2464518 0.82 BTK (0.44) BTKSRCKITFLT3ITK
SCHEMBL2464238 0.81 BTK (0.42) BTKSRCKITFLT3ITK
SCHEMBL2465215 0.81 BTK (0.44) BTKP2RX7
SCHEMBL2462692 0.79 BTK (0.43) BTKSRCKITFLT3ITK

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-8598174-B2 Pyridazinones, method of making, and method of use thereof GENETECH, INC. (US) 2013-12-03 US claimed
US-20110301145-A1 PYRIDAZINONES, METHOD OF MAKING, AND METHOD OF USE THEREOF Gilead Connecticut INc. (US) 2011-12-08 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
EP-2365970-A1 Pyridazinones and their use as btk inhibitors CGI Pharmaceuticals, Inc. (US) 2011-09-21 EP disclosed
WO-2010056875-A1 PYRIDAZINONES AND THEIR USE AS BTK INHIBITORS CGI PHARMACEUTICALS, INC. (US) 2010-05-20 WO disclosed
WO-2010056875-A1 PYRIDAZINONES AND THEIR USE AS BTK INHIBITORS CGI PHARMACEUTICALS, INC. (US) 2010-05-20 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-20110301145-A1 PYRIDAZINONES, METHOD OF MAKING, AND METHOD OF USE THEREOF BTK, SYK, LCK BTK 1/4885SRC 139/4885KIT 77/4885

“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.