SCHEMBL30867125

SCHEMBL30867125

O=c1[nH]cccc1-c1nc(OCCc2c[nH]c3ccccc23)c2ncsc2n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38
SSTR2 P30874 1/20 0.37
SSTR4 P31391 1/20 0.37
NQO1 P15559 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
GSK3B P49841 1/20 0.35
NEK4 P51957 1/20 0.35
CSNK2A1 P68400 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
STAT3 P40763 1/20 0.34
HTR1A P08908 3/20 0.34
HTR2A P28223 2/20 0.34

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
SCHEMBL27318948 1.00 MAPT (0.38) MAPTMEN1KMT2ANPC1GAA
SCHEMBL27321147 0.89 MPO (0.37) KMT2AHTR1AHTR2AMPO
SCHEMBL31534087 0.89 LMNA (0.40) MAPTMEN1KMT2ATDP1LMNA
SCHEMBL31534081 0.88 MTNR1A (0.37) NQO1PDPK1
SCHEMBL27319322 0.88 MTNR1A (0.37) NQO1PDPK1
SCHEMBL30867175 0.85 NQO1 (0.46) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL27318674 0.85 NQO1 (0.46) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL31534082 0.84 HTR1A (0.39) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL30867152 0.84 SSTR2 (0.39) KMT2ANPC1RAB9ASSTR2SSTR4
SCHEMBL27318958 0.84 HTR1A (0.39) MAPTMEN1KMT2ANPC1RAB9A

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