SCHEMBL30867184

SCHEMBL30867184

Fc1cccc(-c2nc(NCCc3c[nH]c4ccccc34)c3ncsc3n2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.49
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
LMNA P02545 5/20 0.47
USP2 O75604 4/20 0.47
CYP1A2 P05177 4/20 0.47
CYP3A4 P08684 4/20 0.47
CYP2D6 P10635 4/20 0.47
CYP2C9 P11712 4/20 0.47
CYP2C19 P33261 4/20 0.47
MAPT P10636 3/20 0.47
MAPK1 P28482 2/20 0.47
TP53 P04637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
CDK4 P11802 3/20 0.47
CCND1 P24385 3/20 0.47
ALDH1A1 P00352 2/20 0.43
CLK4 Q9HAZ1 2/20 0.43
HIF1A Q16665 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL27319347 1.00 GBA1 (0.49) GBA1KMT2AMEN1LMNAUSP2
SCHEMBL27319354 0.93 GBA1 (0.48) GBA1KMT2AMEN1LMNAUSP2
SCHEMBL30867159 0.93 GBA1 (0.48) GBA1KMT2AMEN1LMNAUSP2
SCHEMBL27319374 0.91 GBA1 (0.49) GBA1KMT2AMEN1LMNAUSP2
SCHEMBL31534058 0.91 GBA1 (0.49) GBA1KMT2AMEN1LMNAUSP2
SCHEMBL31534072 0.85 CDK4 (0.43) KMT2AMEN1LMNAUSP2CYP1A2
SCHEMBL30867197 0.85 GBA1 (0.69) GBA1KMT2AMEN1LMNAUSP2
SCHEMBL30867186 0.84 GBA1 (0.55) GBA1KMT2AMEN1LMNAUSP2
SCHEMBL27319390 0.84 GBA1 (0.55) GBA1KMT2AMEN1LMNAUSP2
SCHEMBL24689903 0.82 GBA1 (0.70) GBA1KMT2AMEN1LMNAUSP2

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