SCHEMBL30465864

SCHEMBL30465864

COc1c(Nc2nc(Cl)ncc2C(=O)O)cccc1-c1ncn(C)n1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 18/20 0.52
▸ JAK1 P23458 6/20 0.52
▸ KCNH2 Q12809 3/20 0.51
▸ JAK2 O60674 3/20 0.51
▸ STAT3 P40763 1/20 0.49

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
SCHEMBL25748683 1.00 TYK2 (0.52) TYK2JAK1KCNH2JAK2STAT3
SCHEMBL25670345 0.92 TYK2 (0.52) TYK2JAK1KCNH2JAK2STAT3
SCHEMBL31369032 0.92 TYK2 (0.52) TYK2JAK1KCNH2JAK2STAT3
SCHEMBL28662538 0.92 TYK2 (0.52) TYK2JAK1KCNH2JAK2STAT3
SCHEMBL29882968 0.91 TYK2 (0.61) TYK2JAK1KCNH2JAK2STAT3
SCHEMBL25750974 0.91 TYK2 (0.61) TYK2JAK1KCNH2JAK2STAT3
SCHEMBL30465823 0.88 TYK2 (0.63) TYK2JAK1KCNH2JAK2STAT3
SCHEMBL27292496 0.88 JAK2 (0.52) TYK2JAK1KCNH2JAK2STAT3
SCHEMBL27199311 0.88 TYK2 (0.63) TYK2JAK1KCNH2JAK2STAT3
Lithium SCHEMBL31017345 0.86 AXL (0.51) TYK2JAK1KCNH2JAK2STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4448514-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF Lynk Pharmaceuticals Co. Ltd. (CN) 2024-10-23 — — EP disclosed
WO-2023109954-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 — — WO disclosed
WO-2023108536-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 — — WO disclosed
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