SCHEMBL6959233

SCHEMBL6959233

Fc1ccc2ccc(CBr)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.48
CYP2A6 P11509 2/20 0.48
CYP19A1 P11511 1/20 0.47
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
KCNH2 Q12809 2/20 0.40
DAO P14920 2/20 0.38
BACE1 P56817 1/20 0.35
MPO P05164 1/20 0.35
IDO1 P14902 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.34
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
AHR P35869 2/20 0.33
CCR3 P51677 1/20 0.33
FCER2 P06734 1/20 0.33
CASP3 P42574 2/20 0.33
SENP8 Q96LD8 2/20 0.33
SENP7 Q9BQF6 2/20 0.33

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
SCHEMBL30843262 0.93 CYP1A2 (0.50) CYP1A2CYP2A6CYP19A1SLC6A2SLC6A4
SCHEMBL2287085 0.93 CYP1A2 (0.50) CYP1A2CYP2A6CYP19A1SLC6A2SLC6A4
SCHEMBL2888187 0.86 CYP1A2 (0.42) CYP1A2CYP2A6BCHEACHE
SCHEMBL31069470 0.86 CYP1A2 (0.42) CYP1A2CYP2A6BCHEACHE
SCHEMBL9718376 0.83 SLC6A2 (0.45) CYP1A2CYP2A6CYP19A1SLC6A2SLC6A4
SCHEMBL9226931 0.80 CYP1A2 (0.35) CYP1A2CYP2A6CYP19A1SLC6A2SLC6A4
SCHEMBL5349984 0.79 CYP1A2 (0.41) CYP1A2CYP2A6SLC6A2SLC6A3BCHE
SCHEMBL6233504 0.78 LOXL2 (0.56) CYP1A2CYP2A6CYP19A1SLC6A2SLC6A4
SCHEMBL8499490 0.78 CYP1A2 (0.48) CYP1A2CYP2A6CYP19A1SLC6A2SLC6A4
SCHEMBL14604942 0.78 CYP1A2 (0.59) CYP1A2CYP2A6CYP19A1SLC6A2SLC6A4

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1183907-C Imidazoline compound, preparing process thereof and pharmaceutical composition contg. same SERVIER LAB (FR) 2005-01-12 CN disclosed
EP-1010693-B1 Imidazoline derivatives, preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-09-24 EP disclosed
US-6127396-A Imidazoline compounds ADIR ET COMPAGNIE (FR) 2000-10-03 US disclosed
CN-1257864-A Imidazoline compound, preparing process thereof and pharmaceutical composition contg. same ADIR (FR) 2000-06-28 CN disclosed
EP-1010693-A1 Imidazoline derivatives, preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-06-21 EP disclosed
EP-0462830-B1 Cyclic ether derivatives ZENECA LTD (GB) 1995-10-18 EP disclosed
EP-0375368-B1 Alcohol and ether derivatives ZENECA LTD (GB) 1995-08-16 EP disclosed
US-5407945-A Pyran derivatives and their use as inhibitors of 5-lipoxygenase IMPERIAL CHEMICAL INDUSTRIES, INC. (GB) 1995-04-18 US disclosed
US-5403859-A PHENYLENE-CYCLIC ETHER COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-04-04 US disclosed
EP-0375452-B1 Cycloalkane derivatives ICI PLC (GB) 1994-10-05 EP disclosed
US-5105020-A Lopoxygerase inhibitors; antiinflammatory agents, antiallergens IMPERIAL CHEMISTRIES INDUSTRIES PLC (GB) 1992-04-14 US disclosed
US-5098932-A Inhibitors of lipoxygenase for treatment of diseases mediated with leukotrienes IMPERIAL CHEMICAL INDUSTRIES PLC, ICI PHARMA (FR) 1992-03-24 US disclosed
US-5098930-A Inhibitors of lipoxygenase for treatment of diseases mediated with leukotrienes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-03-24 US disclosed
US-5089513-A Antiinflammatory agents; antiallergens; asthma; side effect reduction ICI PHARMA (FR) 1992-02-18 US disclosed
EP-0462830-A2 Cyclic ether derivatives ZENECA LIMITED (GB) 1991-12-27 EP disclosed
EP-0375457-A2 Cyclic ether derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-27 EP disclosed
EP-0375368-A2 Alcohol and ether derivatives ZENECA LIMITED (GB) 1990-06-27 EP disclosed
EP-0375452-A2 Cycloalkane derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-27 EP disclosed
EP-0375404-A2 Heterocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-27 EP disclosed
EP-0351194-A2 Thiazole derivatives having a 5-lipoxygenase-inhibiting activity IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-01-17 EP disclosed