SCHEMBL24808397

SCHEMBL24808397

CN(c1cncc(Br)n1)c1nc(Cl)nc2cc(Cl)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.36
PDGFRB P09619 1/20 0.36
KDR P35968 1/20 0.36
POLB P06746 1/20 0.35
NR4A2 P43354 1/20 0.34
CSNK2A2 P19784 1/20 0.33
CSNK2B P67870 1/20 0.33
CHKA P35790 1/20 0.32
BCHE P06276 2/20 0.32
ACHE P22303 2/20 0.32
CHRM1 P11229 1/20 0.32
EPHX2 P34913 1/20 0.32
HTT P42858 1/20 0.31
MAT2A P31153 1/20 0.31
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31
TUBB4B P68371 1/20 0.31

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
SCHEMBL30014123 0.84 EGFR (0.39) EGFRPDGFRBKDRPOLBNR4A2
SCHEMBL23577130 0.84 EGFR (0.39) EGFRPDGFRBKDRPOLBNR4A2
SCHEMBL30095578 0.76 MAT2A (0.62) MAT2AMPO
SCHEMBL24808398 0.76 MAT2A (0.62) MAT2AMPO
SCHEMBL30095584 0.75 MAT2A (0.62) MAT2A
SCHEMBL24808619 0.75 MAT2A (0.62) MAT2A
SCHEMBL30014065 0.74 EGFR (0.35) EGFRPDGFRBKDRPOLBNR4A2
SCHEMBL23577333 0.74 EGFR (0.35) EGFRPDGFRBKDRPOLBNR4A2
SCHEMBL23577239 0.74 MAT2A (0.36) MAT2A
SCHEMBL29909065 0.74 MAT2A (0.36) MAT2A

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-2022271677-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2022-12-29 WO disclosed