SCHEMBL19624892

SCHEMBL19624892

Cc1c(-c2ccc(Oc3ccccc3)cc2)nn(C2CCCCN(C(=O)OC(C)(C)C)C2)c1C=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.52
EGFR P00533 4/20 0.48
TEC P42680 3/20 0.46
BMX P51813 3/20 0.46
TXK P42681 2/20 0.46
LYN P07948 2/20 0.46
FGFR2 P21802 2/20 0.46
ITK Q08881 2/20 0.46
RIPK2 O43353 1/20 0.46
NR1I2 O75469 1/20 0.46
SLC22A3 O75751 1/20 0.46
LATS1 O95835 1/20 0.46
NUDT14 O95848 1/20 0.46
ABL1 P00519 1/20 0.46
ERBB2 P04626 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
PGR P06401 1/20 0.46
CSF1R P07333 1/20 0.46
YES1 P07947 1/20 0.46

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
SCHEMBL19624445 0.94 BTK (0.51) BTKEGFRLCK
SCHEMBL25060294 0.89 BTK (0.49) BTKEGFRITKLCKSRC
SCHEMBL19624641 0.86 BTK (0.52) BTKEGFRITKLCKSRC
SCHEMBL25060477 0.83 BTK (0.48) BTKEGFRLCK
SCHEMBL19624840 0.82 BTK (0.52) BTKEGFRFLT3
SCHEMBL20411964 0.81 BTK (0.62) BTKEGFRSRC
SCHEMBL19624642 0.80 BTK (0.51) BTKEGFRTECBMXTXK
SCHEMBL19533629 0.80 BTK (0.49) BTKEGFRFLT3
SCHEMBL20411963 0.80 BTK (0.52) BTKEGFRITKLCKSRC
SCHEMBL19533529 0.80 BTK (0.55) BTKEGFRITKLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3246317-B1 BTK INHIBITOR HUBEI BIO PHARMACEUTICAL INDUSTRIAL TECH INSTITUTE INC (CN) 2023-02-22 EP disclosed
EP-3246317-A1 BTK INHIBITOR Hubei Bio-Pharmaceutical Industrial Technological Institute Inc. (CN) 2017-11-22 EP disclosed