SCHEMBL30718150

SCHEMBL30718150

CC(C)(C)OC(=O)N1CC(N2CC[C@H](n3nc(-c4ccc(Oc5ccccc5)cc4)c4c(N)ncnc43)[C@@H](F)C2)C1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.64
EGFR P00533 4/20 0.57
ITK Q08881 3/20 0.57
LCK P06239 3/20 0.57
TEC P42680 3/20 0.57
BMX P51813 3/20 0.57
LYN P07948 3/20 0.57
TXK P42681 2/20 0.57
FGFR2 P21802 2/20 0.57
FLT3 P36888 2/20 0.57
RIPK2 O43353 1/20 0.57
NR1I2 O75469 1/20 0.57
SLC22A3 O75751 1/20 0.57
LATS1 O95835 1/20 0.57
NUDT14 O95848 1/20 0.57
ABL1 P00519 1/20 0.57
ERBB2 P04626 1/20 0.57
FYN P06241 1/20 0.57
PGR P06401 1/20 0.57
CSF1R P07333 1/20 0.57

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
SCHEMBL29836314 1.00 BTK (0.64) BTKEGFRITKLCKTEC
SCHEMBL30718148 1.00 BTK (0.64) BTKEGFRITKLCKTEC
SCHEMBL30718153 1.00 BTK (0.64) BTKEGFRITKLCKTEC
SCHEMBL22720892 1.00 BTK (0.64) BTKEGFRITKLCKTEC
SCHEMBL22720728 1.00 BTK (0.64) BTKEGFRITKLCKTEC
SCHEMBL24827868 1.00 BTK (0.64) BTKEGFRITKLCKTEC
SCHEMBL22720754 1.00 BTK (0.64) BTKEGFRITKLCKTEC
SCHEMBL22720750 1.00 BTK (0.64) BTKEGFRITKLCKTEC
SCHEMBL22720845 1.00 BTK (0.64) BTKEGFRITKLCKTEC
SCHEMBL30718149 1.00 BTK (0.64) BTKEGFRITKLCKTEC

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
CN-118027041-A BTK inhibitor ring derivative and preparation method and pharmaceutical application thereof 西藏海思科制药有限公司 2024-05-14 CN disclosed
CN-113544130-B BTK inhibitor ring derivative and preparation method and pharmaceutical application thereof 西藏海思科制药有限公司 2024-01-09 CN disclosed