SCHEMBL27316637

SCHEMBL27316637

Cc1cc2c3c(cc(Br)c4c5ccc6c7c(ccc(c1c34)c75)C(=O)OC6=O)C(=O)OC2=O

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TYMS P04818 4/20 0.34
BCL2 P10415 1/20 0.33
BRD1 O95696 1/20 0.31
TAF1 P21675 1/20 0.31
BRPF1 P55201 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
AR P10275 1/20 0.30

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
SCHEMBL12744266 0.91 TYMS (0.40) TYMSBCL2MEN1POLBKMT2A
SCHEMBL13590977 0.87 TYMS (0.33) TYMSMEN1POLBKMT2AAR
SCHEMBL32670397 0.86 TYMS (0.41) TYMSBCL2MEN1POLBKMT2A
SCHEMBL2607526 0.86 TYMS (0.41) TYMSMEN1POLBKMT2AAR
SCHEMBL29580210 0.86 TYMS (0.41) TYMSBCL2MEN1POLBKMT2A
SCHEMBL4324585 0.86 TYMS (0.41) TYMSBCL2MEN1POLBKMT2A
SCHEMBL14290229 0.78 TYMS (0.35) TYMSBCL2
SCHEMBL14296961 0.77 TYMS (0.33) TYMS
SCHEMBL3077539 0.75 TYMS (0.50) TYMSBCL2MEN1POLBKMT2A
SCHEMBL12744260 0.75 ALOX15 (0.40) TYMS

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-2024094829-A1 RYLENE-BASED UV CURABLE SECURITY INK COMPOSITIONS SICPA HOLDING SA (CH) 2024-05-10 WO disclosed