SCHEMBL26420237

SCHEMBL26420237

CC(C)(F)Cn1cc(C(N)=O)c(C#N)n1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AR P10275 7/20 0.36
ADORA3 P0DMS8 1/20 0.35
ADRA1D P25100 1/20 0.35
JAK2 O60674 8/20 0.33
JAK1 P23458 8/20 0.33
PGR P06401 1/20 0.33
PARP1 P09874 1/20 0.33

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
SCHEMBL28309161 0.81 JAK3 (0.41) JAK2JAK1PARP1
SCHEMBL26406052 0.80 ADORA3 (0.38) ADORA3ADRA1DJAK1PARP1
SCHEMBL26406187 0.80 ADORA3 (0.41) ADORA3ADRA1DJAK2JAK1PARP1
SCHEMBL26419960 0.78 LMNA (0.39) ADORA3ADRA1D
SCHEMBL30621006 0.77 TGFBR1 (0.36) JAK2JAK1PARP1
SCHEMBL26135704 0.76 ADORA3 (0.36) ADORA3ADRA1DPARP1
SCHEMBL26419133 0.76 ADORA2A (0.37) JAK2JAK1PARP1
SCHEMBL31253880 0.69 ROCK2 (0.36) JAK2JAK1
SCHEMBL22262871 0.67 KLKB1 (0.48) ADRA1DPARP1
SCHEMBL20531574 0.67 KLKB1 (0.49) JAK2JAK1PARP1

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
CN-119095839-A Quinoline derivatives as modulators and related products of Mas-associated G protein receptor X2 伊赛恩特制药公司 2024-12-06 CN disclosed
WO-2023192901-A9 QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS ESCIENT PHARMACEUTICALS, INC. (US) 2023-12-14 WO disclosed
WO-2023192901-A1 QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS ESCIENT PHARMACEUTICALS, INC. (US) 2023-10-05 WO disclosed