SCHEMBL30977445

SCHEMBL30977445

C[Si](C)(C)c1cc2ccc(C(F)(F)F)cn2n1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.33
MAOB P27338 1/20 0.32
CYP1A2 P05177 2/20 0.31
F2RL3 Q96RI0 1/20 0.31
GAA P10253 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
AHR P35869 1/20 0.31
SCN5A Q14524 1/20 0.30
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 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
SCHEMBL25028929 0.76 NOS3 (0.39) MAPK14MAOBKDM4EHSD17B10AHR
SCHEMBL5395605 0.73 F2RL3 (0.42) MAPK14F2RL3KDM4EAHRSCN5A
SCHEMBL6601087 0.72 TP53 (0.44) KDM4EHSD17B10
SCHEMBL25371122 0.72 MAPK14 (0.35) MAPK14MAOBKDM4EHSD17B10AHR
SCHEMBL17252261 0.71 MARS1 (0.41) CYP1A2KDM4EHSD17B10
SCHEMBL22361048 0.71 GABRA2 (0.35) MAPK14
SCHEMBL25027517 0.70 MAP4K4 (0.56) CYP1A2KDM4E
SCHEMBL3186083 0.70 MAPK14 (0.47) MAPK14CYP1A2F2RL3GAAKDM4E
SCHEMBL25220159 0.69 KIF11 (0.38) MAPK14KDM4EHSD17B10AHRSCN5A
SCHEMBL6599132 0.69 TRPA1 (0.43) MAPK14AHR

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-4619402-A1 GPR17 MODULATORS AND USES THEREOF Myrobalan Therapeutics, Inc. (US) 2025-09-24 EP disclosed
CN-119613397-A N-heteroaromatic ring-3-sulfonamide compounds and use thereof for preparing GPR17 receptor inhibitors 迈巴制药(南京)有限公司 2025-03-14 CN disclosed
WO-2024104462-A1 GPR17 MODULATORS AND USES THEREOF MYROBALAN THERAPEUTICS NANJING CO. LTD (CN) 2024-05-23 WO disclosed