SCHEMBL2494710

SCHEMBL2494710

Cc1cc(Nc2cc(-c3ccc(F)c(NC(=O)c4cc5c(s4)CCCC5)c3)n[nH]c2=O)no1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 11/20 0.51
RAB9A P51151 9/20 0.42
NPC1 O15118 7/20 0.42
SMN1; SMN2 Q16637 6/20 0.42
HPGD P15428 4/20 0.42
TSHR P16473 3/20 0.42
NFKB1 P19838 2/20 0.42
NFKB2 Q00653 2/20 0.42
RELA Q04206 2/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 6/20 0.42
TP53 P04637 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ALOX15 P16050 1/20 0.42
MAPT P10636 3/20 0.40
FGR P09769 1/20 0.39
SRC P12931 1/20 0.39
TEC P42680 1/20 0.39
BMX P51813 1/20 0.39
LMNA P02545 3/20 0.39

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
SCHEMBL2491965 0.86 BTK (0.57) BTKRAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL9984355 0.85 BTK (0.54) BTKRAB9ANPC1SMN1; SMN2HPGD
SCHEMBL9985266 0.85 BTK (0.51) BTKRAB9ANPC1SMN1; SMN2HPGD
SCHEMBL9984648 0.85 BTK (0.49) BTKRAB9ANPC1SMN1; SMN2HPGD
SCHEMBL19971524 0.84 BTK (0.50) BTKRAB9ANPC1SMN1; SMN2HPGD
SCHEMBL2492538 0.84 BTK (0.51) BTKRAB9ANPC1SMN1; SMN2HPGD
SCHEMBL9985006 0.83 BTK (0.54) BTKFGRSRCTECBMX
SCHEMBL9984360 0.83 BTK (0.52) BTKRAB9ANPC1SMN1; SMN2HPGD
SCHEMBL2494292 0.82 BTK (0.52) BTKRAB9ANPC1SMN1; SMN2HPGD
SCHEMBL2490771 0.81 BTK (0.52) BTKRAB9ANPC1SMN1; SMN2HPGD

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 9 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
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
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

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 1/4885RAB9A 3665/4885NPC1 3233/4885

“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.