SCHEMBL30923201

SCHEMBL30923201

COc1c(Nc2ncncc2C(=O)O)cccc1-c1nnc(C)o1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 6/20 0.51
▸ JAK1 P23458 3/20 0.51
▸ DHODH Q02127 4/20 0.36
▸ ERBB2 P04626 1/20 0.36
▸ LCK P06239 1/20 0.36
▸ FGFR1 P11362 1/20 0.36
▸ FLT1 P17948 1/20 0.36
▸ FGFR2 P21802 1/20 0.36
▸ FGFR4 P22455 1/20 0.36
▸ FGFR3 P22607 1/20 0.36
▸ FLT4 P35916 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ EGFR P00533 1/20 0.36
▸ AGTR1 P30556 1/20 0.36
▸ AGTR2 P50052 1/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35

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
SCHEMBL30923204 1.00 TYK2 (0.51) TYK2JAK1DHODHERBB2LCK
SCHEMBL29883000 0.91 TYK2 (0.60) TYK2JAK1
SCHEMBL27294015 0.79 TYK2 (0.59) TYK2JAK1
SCHEMBL27417191 0.77 JAK3 (0.49) TYK2JAK1KDR
SCHEMBL31711619 0.77 TYK2 (0.52) TYK2JAK1
SCHEMBL27293373 0.75 JAK1 (0.44) TYK2JAK1
SCHEMBL27293253 0.74 TYK2 (0.49) TYK2JAK1ALOX15HSD17B10
SCHEMBL31711666 0.74 TYK2 (0.49) TYK2JAK1ALOX15HSD17B10
SCHEMBL27293368 0.74 TYK2 (0.45) TYK2JAK1
SCHEMBL30923245 0.73 TYK2 (0.43) TYK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4618975-A2 INHIBITORS OF TYK2 Vyrnwy Therapeutics, Inc. (US) 2025-09-24 — — EP disclosed
WO-2024107658-A2 INHIBITORS OF TYK2 VYRNWY THERAPEUTICS, INC. (US) 2024-05-23 — — WO disclosed
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