SCHEMBL30867177

SCHEMBL30867177

Fc1ccc2[nH]cc(CCOc3ncnc4scnc34)c2c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MPO P05164 16/20 0.46
HTR2A P28223 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
SLC6A4 P31645 5/20 0.46
HTR1A P08908 2/20 0.45
KMT2A Q03164 1/20 0.45
GPR84 Q9NQS5 1/20 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
SCHEMBL30867130 0.85 MPO (0.44) MPOHTR2ATRPM8SLC6A4HTR1A
SCHEMBL27319943 0.85 MPO (0.44) MPOHTR2ATRPM8SLC6A4HTR1A
SCHEMBL31534055 0.82 MPO (0.42) MPOHTR2ATRPM8SLC6A4HTR1A
SCHEMBL27320817 0.82 MPO (0.42) MPOHTR2ATRPM8SLC6A4HTR1A
SCHEMBL30867211 0.81 HTR1A (0.43) MPOHTR2ATRPM8SLC6A4HTR1A
SCHEMBL27319956 0.81 HTR1A (0.43) MPOHTR2ATRPM8SLC6A4HTR1A
SCHEMBL31534084 0.80 MPO (0.41) MPOHTR2ATRPM8SLC6A4HTR1A
SCHEMBL30867132 0.80 MPO (0.54) MPOHTR2ATRPM8SLC6A4HTR1A
SCHEMBL30867173 0.80 MPO (0.40) MPOHTR2ATRPM8SLC6A4HTR1A
SCHEMBL30867157 0.80 MPO (0.42) MPOHTR2ATRPM8SLC6A4HTR1A

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 2 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
WO-2024076300-A1 COMPOUNDS USEFUL IN MODULATION OF AHR SIGNALLING JAGUAHR THERAPEUTICS PTE LTD (SG) 2024-04-11 WO disclosed