SCHEMBL10880576

SCHEMBL10880576

Fc1ncnc(Nc2ccccc2)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 1/20 0.62
▸ AURKA O14965 6/20 0.54
▸ CDK2 P24941 4/20 0.54
▸ GSK3B P49841 4/20 0.54
▸ FLT3 P36888 3/20 0.54
▸ CDK5 Q00535 3/20 0.54
▸ STK17A Q9UEE5 3/20 0.54
▸ AURKB Q96GD4 3/20 0.54
▸ JAK2 O60674 3/20 0.54
▸ PDPK1 O15530 2/20 0.54
▸ CDK1 P06493 2/20 0.54
▸ LYN P07948 2/20 0.54
▸ FGFR1 P11362 2/20 0.54
▸ FGFR3 P22607 2/20 0.54
▸ RPS6KB1 P23443 2/20 0.54
▸ MARK3 P27448 2/20 0.54
▸ BLK P51451 2/20 0.54
▸ RPS6KA3 P51812 2/20 0.54
▸ ERBB4 Q15303 2/20 0.54
▸ MARK2 Q7KZI7 2/20 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
SCHEMBL824411 0.86 BCL6 (0.74) BCL6AURKACDK2GSK3BFLT3
SCHEMBL9685913 0.79 MEN1 (0.57) AURKACDK2GSK3BFLT3CDK5
SCHEMBL27598771 0.79 CDC7 (0.69) BCL6AURKACDK2GSK3BFLT3
SCHEMBL5808094 0.78 BCL6 (0.65) BCL6AURKACDK2GSK3BFLT3
SCHEMBL19836613 0.77 BCL6 (0.62) BCL6AURKACDK2GSK3BFLT3
SCHEMBL5598234 0.77 BCL6 (0.62) BCL6AURKACDK2GSK3BFLT3
SCHEMBL5137042 0.77 BCL6 (0.62) BCL6AURKACDK2GSK3BFLT3
SCHEMBL4795724 0.77 MAPT (0.66) BCL6AURKACDK2GSK3BFLT3
Amanozine SCHEMBL689928 0.77 BCL6 (1.00) BCL6AURKACDK2PDPK1CDK1
Amanozine SCHEMBL30264199 0.77 BCL6 (1.00) BCL6AURKACDK2PDPK1CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0053743-B1 REACTIVE DIOXAZINE DYESTUFFS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN DYEING AND PRINTING FIBROUS MATERIALS CONTAINING HYDROXYLE OR AMIDE GROUPS BAYER AG (DE) 1986-05-14 — — EP disclosed
US-4400504-A DYEING AND PRINTING CELLULOSE AND POLYAMIDE AND-URETHANE FIBERS; TRIAZINE, PYRIDINE AND PYRIMIDINE DYES BAYER AKTIENGESELLSCHAFT (DE) 1983-08-23 — — US disclosed
EP-0053743-A2 Reactive dioxazine dyestuffs, process for their preparation and their use in dyeing and printing fibrous materials containing hydroxyle or amide groups BAYER AG (DE) 1982-06-16 — — EP disclosed
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