SCHEMBL8878419

SCHEMBL8878419

CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3c(Cl)ccnc32)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 3/20 0.74
PTAFR P25105 3/20 0.74
FNTA P49354 2/20 0.74
FNTB P49356 2/20 0.74
SLC6A15 Q9H2J7 2/20 0.74

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
SCHEMBL8878165 0.91 HRH1 (0.73) HRH1PTAFRFNTAFNTBSLC6A15
SCHEMBL7826039 0.91 SLC6A15 (0.61) HRH1PTAFRFNTAFNTBSLC6A15
SCHEMBL5473193 0.87 SLC6A15 (0.82) HRH1PTAFRSLC6A15
Sch-37370 SCHEMBL29754039 0.85 PTAFR (1.00) HRH1PTAFRFNTAFNTBSLC6A15
Sch-37370 SCHEMBL3071641 0.85 PTAFR (1.00) HRH1PTAFRFNTAFNTBSLC6A15
Sch-37370 SCHEMBL29626524 0.85 PTAFR (1.00) HRH1PTAFRFNTAFNTBSLC6A15
SCHEMBL6181380 0.84 FNTA (0.77) FNTAFNTBSLC6A15
SCHEMBL6178757 0.83 FNTA (0.81) HRH1PTAFRFNTAFNTBSLC6A15
SCHEMBL8879543 0.82 SLC6A15 (0.50) HRH1PTAFRFNTAFNTBSLC6A15
SCHEMBL7818381 0.81 SLC6A15 (0.60) HRH1PTAFRFNTAFNTBSLC6A15

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
US-5665726-A ANTIALLERGIC, ANTIINFLAMMATORY AGENTS SCHERING CORPORATION (US) 1997-09-09 US disclosed
US-5089496-A Benzo[5,6]cycloheptapyridine compounds, compositions and method of treating allergies SCHERING CORPORATION (US) 1992-02-18 US disclosed