SCHEMBL31123095

SCHEMBL31123095

c1n[nH]cc1-c1cc(C2CC2)c2c(ccc3[nH]ncc32)n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 12/20 0.63
▸ CCNA1 P78396 12/20 0.63
▸ FLT3 P36888 9/20 0.63
▸ STING1 Q86WV6 1/20 0.52
▸ ROCK2 O75116 1/20 0.44
▸ CCNT1 O60563 1/20 0.39
▸ CDK1 P06493 1/20 0.39
▸ CCNB1 P14635 1/20 0.39
▸ CCNA2 P20248 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ CDK9 P50750 1/20 0.39
▸ PIM1 P11309 1/20 0.37
▸ PIM3 Q86V86 1/20 0.37
▸ PIM2 Q9P1W9 1/20 0.37
▸ MAP4K1 Q92918 1/20 0.37
▸ MAP3K5 Q99683 1/20 0.37
▸ FGFR1 P11362 1/20 0.36
▸ FGFR2 P21802 1/20 0.36
▸ FGFR3 P22607 1/20 0.36
▸ KDR P35968 1/20 0.36

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
SCHEMBL31252655 0.82 CDK2 (0.59) CDK2CCNA1FLT3STING1CCNA2
SCHEMBL31252652 0.81 CDK2 (0.58) CDK2CCNA1FLT3ROCK2MAP4K1
SCHEMBL22467416 0.79 CDK2 (0.71) CDK2CCNA1FLT3
SCHEMBL31123075 0.77 CDK2 (0.50) CDK2CCNA1FLT3STING1ROCK2
SCHEMBL22478152 0.75 CDK2 (0.66) CDK2CCNA1FLT3STING1
SCHEMBL22478154 0.75 CDK2 (0.66) CDK2CCNA1FLT3STING1
SCHEMBL31252649 0.75 FLT3 (0.51) CDK2CCNA1FLT3STING1MAP4K1
SCHEMBL22477860 0.74 CDK2 (0.65) CDK2CCNA1FLT3STING1
SCHEMBL22466974 0.68 FLT3 (1.00) CDK2CCNA1FLT3STING1ROCK2
SCHEMBL31123088 0.68 FLT3 (0.95) CDK2CCNA1FLT3STING1ROCK2

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-4688157-A1 3H-PYRAZOLO[4.3:f] QUINOLINE-BASED COMPOUNDS AS STING ANTAGONISTS Purdue Research Foundation (US) 2026-02-11 — — EP disclosed
WO-2024206164-A1 3H-PYRAZOLO[4.3:f] QUINOLINE-BASED COMPOUNDS AS STING ANTAGONISTS PURDUE RESEARCH FOUNDATION (US) 2024-10-03 — — WO disclosed
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