SCHEMBL30867162

SCHEMBL30867162

Cn1cc(-c2nc(OCCc3c[nH]c4ccc(Cl)cc34)c3ncsc3n2)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.39
HCRTR2 O43614 1/20 0.37
CDK4 P11802 1/20 0.37
CCND1 P24385 1/20 0.37
HTR2A P28223 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
SLC6A4 P31645 2/20 0.36
ADORA3 P0DMS8 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35
ADORA1 P30542 1/20 0.35
IP6K1 Q92551 1/20 0.35
GPR84 Q9NQS5 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 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
SCHEMBL27319874 1.00 HTR1A (0.39) HTR1AHCRTR2CDK4CCND1HTR2A
SCHEMBL27321120 0.90 MPO (0.40) HTR1ACDK4CCND1HTR2ATRPM8
SCHEMBL30867133 0.90 MPO (0.40) HTR1ACDK4CCND1HTR2ATRPM8
SCHEMBL30867172 0.88 ABCC1 (0.36) HTR1AHTR2A
SCHEMBL27319560 0.88 ABCC1 (0.36) HTR1AHTR2A
SCHEMBL27320810 0.85 SNCA (0.41) HTR1ACDK4CCND1HTR2ATRPM8
SCHEMBL30867161 0.85 SNCA (0.41) HTR1ACDK4CCND1HTR2ATRPM8
SCHEMBL30867191 0.84 SNCA (0.40) HTR1ACDK4CCND1HTR2ATRPM8
SCHEMBL30867194 0.83 HPGD (0.45) CDK4CCND1HTR2ATRPM8GPR84
SCHEMBL30867131 0.82 HTR2A (0.39) HTR1ACDK4CCND1HTR2ATRPM8

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