SCHEMBL30867186

SCHEMBL30867186

c1ccc2c(CCNc3nc(-c4cncnc4)nc4scnc34)c[nH]c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.55
LMNA P02545 5/20 0.47
MAPK1 P28482 4/20 0.47
HTT P42858 2/20 0.47
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GFER P55789 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KMT2A Q03164 5/20 0.44
PDPK1 O15530 1/20 0.44
RPS6KB1 P23443 1/20 0.44
POLB P06746 1/20 0.44
SLC2A1 P11166 1/20 0.44
RAD52 P43351 1/20 0.44
CYP1A2 P05177 6/20 0.44
CYP3A4 P08684 6/20 0.44
CYP2D6 P10635 6/20 0.44
CYP2C19 P33261 6/20 0.44
CLK4 Q9HAZ1 5/20 0.44
ALDH1A1 P00352 5/20 0.44

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
SCHEMBL27319390 1.00 GBA1 (0.55) GBA1LMNAMAPK1HTTMAPT
SCHEMBL30867197 0.91 GBA1 (0.69) GBA1LMNAMAPK1HTTMAPT
SCHEMBL27319374 0.88 GBA1 (0.49) GBA1LMNAMAPK1HTTMAPT
SCHEMBL31534058 0.88 GBA1 (0.49) GBA1LMNAMAPK1HTTMAPT
SCHEMBL27319878 0.86 GBA1 (0.49) GBA1LMNAMAPK1HTTMAPT
SCHEMBL30867198 0.86 GBA1 (0.49) GBA1LMNAMAPK1HTTMAPT
SCHEMBL30867159 0.86 GBA1 (0.48) GBA1LMNAMAPK1HTTMAPT
SCHEMBL27319354 0.86 GBA1 (0.48) GBA1LMNAMAPK1HTTMAPT
SCHEMBL30867184 0.84 GBA1 (0.49) GBA1LMNAMAPK1HTTMAPT
SCHEMBL27319347 0.84 GBA1 (0.49) GBA1LMNAMAPK1HTTMAPT

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-4598931-A1 COMPOUNDS USEFUL IN MODULATION OF AHR SIGNALLING JAGUAHR THERAPEUTICS PTE LTD (SG) 2025-08-13 EP disclosed
CN-119948035-A Compounds useful for modulating AhR signaling 捷豹治疗有限公司 2025-05-06 CN disclosed
WO-2024076300-A1 COMPOUNDS USEFUL IN MODULATION OF AHR SIGNALLING JAGUAHR THERAPEUTICS PTE LTD (SG) 2024-04-11 WO disclosed