SCHEMBL30144420

SCHEMBL30144420

Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2[C@@H]1CCCN(C2CCNCC2)C1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.73
▸ LCK P06239 4/20 0.72
▸ LYN P07948 3/20 0.72
▸ SRC P12931 2/20 0.66
▸ KDR P35968 2/20 0.66
▸ TEK Q02763 1/20 0.66
▸ EGFR P00533 4/20 0.65
▸ TEC P42680 3/20 0.65
▸ BMX P51813 3/20 0.65
▸ ITK Q08881 3/20 0.65
▸ TXK P42681 2/20 0.65
▸ FGFR2 P21802 2/20 0.65
▸ NUDT14 O95848 2/20 0.65
▸ NUDT5 Q9UKK9 2/20 0.65
▸ BLK P51451 2/20 0.65
▸ RIPK2 O43353 1/20 0.65
▸ NR1I2 O75469 1/20 0.65
▸ SLC22A3 O75751 1/20 0.65
▸ LATS1 O95835 1/20 0.65
▸ ABL1 P00519 1/20 0.65

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
SCHEMBL25075088 1.00 BTK (0.73) BTKLCKLYNSRCKDR
SCHEMBL30144415 1.00 BTK (0.73) BTKLCKLYNSRCKDR
SCHEMBL26096075 1.00 BTK (0.73) BTKLCKLYNSRCKDR
SCHEMBL22720689 0.92 BTK (0.73) BTKLCKLYNSRCKDR
SCHEMBL29439120 0.92 BTK (0.73) BTKLCKLYNSRCKDR
SCHEMBL22737493 0.92 BTK (0.73) BTKLCKLYNSRCKDR
SCHEMBL22720764 0.91 BTK (0.70) BTKLCKLYNSRCKDR
SCHEMBL29439154 0.91 BTK (0.70) BTKLCKLYNSRCKDR
SCHEMBL22720888 0.90 BTK (0.69) BTKLCKLYNSRCKDR
SCHEMBL22720662 0.90 BTK (0.71) BTKLCKLYNSRCKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023023537-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BRUTON'S TYROSINE KINASE ENDOTARGET INC. (US) 2023-02-23 — — WO claimed
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