SCHEMBL8880503

SCHEMBL8880503

CC(=O)N1CCC(=C2c3cc(Cl)ccc3CCc3cccnc32)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 13/20 1.00
SLC6A15 Q9H2J7 9/20 0.84
HRH1 P35367 4/20 0.84
FNTA P49354 3/20 0.84
FNTB P49356 3/20 0.84
MEN1 O00255 1/20 0.64
NPC1 O15118 1/20 0.64
CACNA1F O60840 1/20 0.64
NR1I2 O75469 1/20 0.64
GMNN O75496 1/20 0.64
USP2 O75604 1/20 0.64
ABCB11 O95342 1/20 0.64
LMNA P02545 1/20 0.64
TP53 P04637 1/20 0.64
CHRM2 P08172 1/20 0.64
ABCB1 P08183 1/20 0.64
CYP3A4 P08684 1/20 0.64
ADORA3 P0DMS8 1/20 0.64
CYP2C8 P10632 1/20 0.64
CYP2D6 P10635 1/20 0.64

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
Sch-37370 SCHEMBL29626524 0.91 PTAFR (1.00) PTAFRSLC6A15HRH1FNTAFNTB
Sch-37370 SCHEMBL29754039 0.91 PTAFR (1.00) PTAFRSLC6A15HRH1FNTAFNTB
Sch-37370 SCHEMBL3071641 0.91 PTAFR (1.00) PTAFRSLC6A15HRH1FNTAFNTB
SCHEMBL8878153 0.88 PTAFR (1.00) PTAFRSLC6A15HRH1FNTAFNTB
SCHEMBL8880891 0.87 PTAFR (1.00) PTAFRSLC6A15HRH1FNTAFNTB
SCHEMBL8877892 0.86 PTAFR (1.00) PTAFRSLC6A15HRH1FNTAFNTB
SCHEMBL8890300 0.86 SLC6A15 (0.86) PTAFRSLC6A15HRH1FNTAFNTB
SCHEMBL8878121 0.84 SLC6A15 (0.86) PTAFRSLC6A15HRH1FNTAFNTB
SCHEMBL8880239 0.83 PTAFR (1.00) PTAFRSLC6A15HRH1FNTAFNTB
SCHEMBL8879783 0.83 PTAFR (0.77) PTAFRSLC6A15HRH1FNTAFNTB

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 9 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
EP-0685476-A1 Benzo(5,6)cycloheptapyridines, compositions and methods of use SCHERING CORPORATION (US) 1995-12-06 EP disclosed
US-5438062-A Antiallergens, antiinflammatory agents SCHERING CORPORATION (US) 1995-08-01 US disclosed
EP-0270818-B1 Benzo(5,6)cycloheptapyridines, compositions and method of use SCHERING CORP (US) 1994-12-28 EP disclosed
US-5089496-A Benzo[5,6]cycloheptapyridine compounds, compositions and method of treating allergies SCHERING CORPORATION (US) 1992-02-18 US disclosed
EP-0330673-A1 BENZO 5,6]CYCLOHEPTAPYRIDINES, COMPOSITIONS AND METHODS OF USE SCHERING CORPORATION (US) 1989-09-06 EP disclosed
US-4826853-A ANTIALLERGENS, ANTIINFLAMMATORY AGENTS SCHERING CORPORATION (US) 1989-05-02 US disclosed
EP-0270818-A1 Benzo(5,6)cycloheptapyridines, compositions and method of use SCHERING CORPORATION (US) 1988-06-15 EP disclosed
WO-1988003138-A1 BENZO[5,6]CYCLOHEPTAPYRIDINES, COMPOSITIONS AND METHODS OF USE SCHERING CORPORATION (US) 1988-05-05 WO disclosed