SCHEMBL27400120

SCHEMBL27400120

Cc1cc(O)c(C)c(-c2c(N)c(C(N)=O)nc3cccnc23)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 1/20 0.39
▸ KDR P35968 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ MKNK2 Q9HBH9 3/20 0.34
▸ MKNK1 Q9BUB5 2/20 0.34
▸ LIMK1 P53667 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ COMT P21964 1/20 0.33
▸ DHODH Q02127 1/20 0.33
▸ PKMYT1 Q99640 3/20 0.33
▸ TLR8 Q9NR97 1/20 0.33
▸ PLK4 O00444 1/20 0.33
▸ MAP4K4 O95819 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ ROS1 P08922 1/20 0.33
▸ PIM1 P11309 1/20 0.33
▸ AXL P30530 1/20 0.33
▸ FLT3 P36888 1/20 0.33
▸ FRK P42685 1/20 0.33

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
SCHEMBL27399916 0.91 PRMT5 (0.38) PRMT5KDRKDM4EPARP1MKNK2
SCHEMBL27398651 0.88 LCK (0.37) PRMT5KDRKDM4EPARP1MKNK2
SCHEMBL27397409 0.87 PKMYT1 (0.42) PRMT5KDM4EPARP1MKNK2MKNK1
SCHEMBL30905534 0.87 PKMYT1 (0.42) PRMT5KDM4EPARP1MKNK2MKNK1
SCHEMBL27399247 0.82 MKNK1 (0.50) PRMT5KDM4EPARP1MKNK2MKNK1
SCHEMBL27400121 0.82 PRMT5 (0.39) PRMT5KDRPARP1MKNK2MKNK1
SCHEMBL30905573 0.81 PKMYT1 (0.42) PRMT5KDM4EPARP1LMNAPKMYT1
SCHEMBL27397362 0.81 PKMYT1 (0.42) PRMT5KDM4EPARP1LMNAPKMYT1
SCHEMBL27399330 0.80 DHODH (0.39) PRMT5PARP1MKNK2MKNK1LIMK1
SCHEMBL27399927 0.80 LIMK1 (0.37) PRMT5KDM4EPARP1MKNK2MKNK1

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-2024112853-A1 COMPOUNDS THAT INHIBIT PKMYT1 EXELIXIS, INC. (US) 2024-05-30 — — WO disclosed
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