SCHEMBL31255717

SCHEMBL31255717

Cc1ncccc1-c1c(N)ccnc1C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 2/20 0.52
▸ MKNK2 Q9HBH9 2/20 0.52
▸ P2RX7 Q99572 1/20 0.39
▸ IKBKB O14920 2/20 0.37
▸ LIMK1 P53667 2/20 0.36
▸ BTK Q06187 2/20 0.34
▸ LCK P06239 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ MYC P01106 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA2B P29275 1/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ KAT2B Q92831 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ AHR P35869 1/20 0.34
▸ RAB9A P51151 1/20 0.34

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
SCHEMBL18076065 0.82 MKNK1 (0.49) MKNK1MKNK2P2RX7IKBKBNPC1
SCHEMBL14844649 0.79 NOS3 (0.40) MKNK1MKNK2IKBKBLIMK1KDM4E
SCHEMBL15882337 0.78 MKNK2 (0.39) MKNK1MKNK2IKBKBLIMK1BTK
SCHEMBL18076069 0.74 MKNK1 (0.50) MKNK1MKNK2P2RX7IKBKBDHODH
SCHEMBL27399247 0.74 MKNK1 (0.50) MKNK1MKNK2P2RX7IKBKBLIMK1
SCHEMBL23067310 0.73 MAP2K3 (0.50) IKBKBBTKKDM4EADORA2AKMT2A
SCHEMBL4560363 0.73 MKNK1 (0.50) MKNK1MKNK2IKBKBLIMK1KDM4E
SCHEMBL31408890 0.72 MAP2K3 (0.42) MKNK1MKNK2IKBKBLIMK1LMNA
SCHEMBL2931259 0.72 MKNK1 (0.43) MKNK1MKNK2P2RX7KDM4EMAPT
SCHEMBL699068 0.71 MKNK1 (0.49) MKNK1MKNK2IKBKBLIMK1KDM4E

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-119317622-A Compounds useful as TYK2 inhibitors, preparation method and application thereof in medicine 上海致根医药科技有限公司 2025-01-14 — — CN disclosed
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