SCHEMBL30415240

SCHEMBL30415240

Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2C1CCN(C2CN(CC3CNC3)C2)CC1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.66
▸ NUDT14 O95848 1/20 0.66
▸ NUDT5 Q9UKK9 1/20 0.66
▸ LCK P06239 4/20 0.65
▸ LYN P07948 1/20 0.65
▸ SRC P12931 1/20 0.64
▸ KDR P35968 1/20 0.64
▸ TEK Q02763 1/20 0.64
▸ EGFR P00533 3/20 0.59
▸ ITK Q08881 2/20 0.56

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
SCHEMBL24196548 1.00 BTK (0.66) BTKNUDT14NUDT5LCKLYN
SCHEMBL24192710 0.98 BTK (0.64) BTKNUDT14NUDT5LCKLYN
SCHEMBL25075181 0.96 BTK (0.65) BTKNUDT14NUDT5LCKLYN
SCHEMBL30144775 0.96 BTK (0.65) BTKNUDT14NUDT5LCKLYN
SCHEMBL24197336 0.94 BTK (0.63) BTKNUDT14NUDT5LCKLYN
SCHEMBL24196821 0.94 BTK (0.68) BTKNUDT14NUDT5LCKLYN
SCHEMBL30144808 0.94 BTK (0.68) BTKNUDT14NUDT5LCKLYN
SCHEMBL24197127 0.94 BTK (0.62) BTKNUDT14NUDT5LCKLYN
SCHEMBL25475099 0.94 BTK (0.62) BTKNUDT14NUDT5LCKLYN
SCHEMBL25475109 0.94 BTK (0.62) BTKNUDT14NUDT5LCKLYN

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
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
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