SCHEMBL30867211

SCHEMBL30867211

Fc1cccc(-c2nc(OCCc3c[nH]c4ccc(F)cc34)c3ncsc3n2)c1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 12/20 0.43
SLC6A4 P31645 6/20 0.43
MPO P05164 5/20 0.40
HTR7 P34969 5/20 0.40
HTR2A P28223 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
KMT2A Q03164 1/20 0.39
ICMT O60725 1/20 0.38

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
SCHEMBL27319956 1.00 HTR1A (0.43) HTR1ASLC6A4MPOHTR7HTR2A
SCHEMBL31534072 0.93 CDK4 (0.43) HTR1ASLC6A4KMT2A
SCHEMBL31534055 0.93 MPO (0.42) HTR1ASLC6A4MPOHTR2ATRPM8
SCHEMBL27320817 0.93 MPO (0.42) HTR1ASLC6A4MPOHTR2ATRPM8
SCHEMBL30867157 0.90 MPO (0.42) HTR1ASLC6A4MPOHTR2ATRPM8
SCHEMBL27319951 0.90 MPO (0.42) HTR1ASLC6A4MPOHTR2ATRPM8
SCHEMBL27320810 0.87 SNCA (0.41) HTR1ASLC6A4MPOHTR2ATRPM8
SCHEMBL30867161 0.87 SNCA (0.41) HTR1ASLC6A4MPOHTR2ATRPM8
SCHEMBL30867191 0.86 SNCA (0.40) HTR1ASLC6A4HTR2ATRPM8
SCHEMBL31534096 0.85 GSK3B (0.39) HTR1ASLC6A4KMT2A

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