SCHEMBL30144808

SCHEMBL30144808

Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2C1CCN(C2CCN(CC3CNC3)CC2)CC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.68
▸ LCK P06239 5/20 0.68
▸ SRC P12931 2/20 0.68
▸ KDR P35968 1/20 0.68
▸ TEK Q02763 1/20 0.68
▸ NUDT14 O95848 1/20 0.67
▸ NUDT5 Q9UKK9 1/20 0.67
▸ LYN P07948 2/20 0.66
▸ EGFR P00533 4/20 0.59
▸ ITK Q08881 3/20 0.56
▸ ABL1 P00519 1/20 0.54
▸ ERBB2 P04626 1/20 0.54
▸ FYN P06241 1/20 0.54
▸ YES1 P07947 1/20 0.54
▸ HCK P08631 1/20 0.54
▸ FGR P09769 1/20 0.54
▸ FER P16591 1/20 0.54
▸ CSK P41240 1/20 0.54
▸ TEC P42680 1/20 0.54
▸ BLK P51451 1/20 0.54

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
SCHEMBL24196821 1.00 BTK (0.68) BTKLCKSRCKDRTEK
SCHEMBL22720911 0.97 BTK (0.71) BTKLCKSRCKDRTEK
SCHEMBL29439261 0.97 BTK (0.71) BTKLCKSRCKDRTEK
SCHEMBL30144775 0.95 BTK (0.65) BTKLCKSRCKDRTEK
SCHEMBL25075181 0.95 BTK (0.65) BTKLCKSRCKDRTEK
SCHEMBL26495555 0.95 BTK (0.69) BTKLCKSRCKDRTEK
SCHEMBL26096706 0.95 BTK (0.69) BTKLCKSRCKDRTEK
SCHEMBL30144752 0.95 BTK (0.69) BTKLCKSRCKDRTEK
SCHEMBL24196548 0.94 BTK (0.66) BTKLCKSRCKDRTEK
SCHEMBL22720853 0.94 BTK (0.66) BTKLCKSRCKDRTEK

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-116134028-A Compound capable of degrading BTK kinase, preparation method and pharmaceutical application thereof 四川海思科制药有限公司 2023-05-16 — — CN disclosed
WO-2023023537-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BRUTON'S TYROSINE KINASE ENDOTARGET INC. (US) 2023-02-23 — — WO disclosed
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