SCHEMBL24548986

SCHEMBL24548986

FC1(F)CCC(c2ccc3[nH]c(Nc4cc(Cl)c5cc[nH]c5c4)nc3c2)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.37
▸ BTK Q06187 3/20 0.36
▸ P2RX7 Q99572 2/20 0.34
▸ KCNH2 Q12809 1/20 0.33
▸ KDR P35968 1/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ JAK1 P23458 1/20 0.32
▸ TYK2 P29597 1/20 0.32
▸ JAK3 P52333 1/20 0.32
▸ PTGES O14684 1/20 0.32
▸ QPCT Q16769 2/20 0.31
▸ PDPK1 O15530 1/20 0.30

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
SCHEMBL24549239 0.88 BTK (0.42) SYKBTKKDRPTGES
SCHEMBL24549464 0.88 SYK (0.37) SYKBTKKCNH2KDRJAK2
SCHEMBL29653718 0.88 SYK (0.37) SYKBTKKCNH2KDRJAK2
SCHEMBL24549228 0.87 SYK (0.38) SYKBTKKCNH2KDRPTGES
SCHEMBL24549235 0.87 SYK (0.38) SYKBTKKCNH2KDRJAK2
SCHEMBL24549232 0.85 KCNH2 (0.44) SYKBTKKCNH2KDR
SCHEMBL24549233 0.84 SYK (0.35) SYKBTKKCNH2KDRPTGES
SCHEMBL29132128 0.84 SYK (0.39) SYKBTKKDR
SCHEMBL24548979 0.84 SYK (0.36) SYKBTKKCNH2KDRPTGES
SCHEMBL29653762 0.84 SYK (0.36) SYKBTKKCNH2KDRPTGES

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-2022133098-A2 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2022-06-23 — — WO disclosed
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