SCHEMBL7757772

SCHEMBL7757772

c1ccc2c(c1)NCCN2NC1=NCCN1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 12/20 0.46
ADRA2B P18089 9/20 0.46
ADRA2C P18825 9/20 0.46
ADRA1D P25100 2/20 0.40
ADRA1A P35348 2/20 0.40
ADRA1B P35368 2/20 0.40
NISCH Q9Y2I1 1/20 0.39

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
SCHEMBL28297314 0.69 AVPR1A (0.38)
SCHEMBL11418621 0.68 NISCH (0.55) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL1862935 0.68 AVPR1A (0.46)
SCHEMBL6054462 0.67 NISCH (0.69) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL11839444 0.65 ADRA2A (0.49) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL9828967 0.65 AVPR1A (0.40)
SCHEMBL9619232 0.65 NISCH (0.58) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL28833094 0.64 BRD4 (0.41)
SCHEMBL19157283 0.63 AVPR1A (0.40)
SCHEMBL305967 0.63 BRPF1 (0.47) NISCH

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0620732-B1 METHODS FOR USING (2-IMIDAZOLIN-2-YLAMINO) QUINOXALINE DERIVATIVES ALLERGAN INC (US) 2001-04-04 EP disclosed
US-5418234-A Methods for using (2-imidazolin-2-ylamino) quinoxaline derivatives ALLERGAN, INC. (US) 1995-05-23 US disclosed
EP-0549594-B1 (2-IMIDAZOLIN-2-YLAMINO) QUINOXALINE DERIVATIVES AND METHODS FOR USING SAME ALLERGAN INC (US) 1995-02-01 EP disclosed
US-5373010-A Methods for using (2-imidazolin-2-ylamino) quinoxaline derivatives ALLERGAN, INC. (US) 1994-12-13 US disclosed
EP-0620732-A1 METHODS FOR USING (2-IMIDAZOLIN-2-YLAMINO) QUINOXALINE DERIVATIVES ALLERGAN, INC. (US) 1994-10-26 EP disclosed
US-5326763-A Methods for using (2-imidazolin-2-ylamino) quinoxaline derivatives ALLERGAN, INC. (US) 1994-07-05 US disclosed
EP-0422878-B1 (2-Imidazolin-2-ylamino) tetrahydroquinoxalines and methods for using same ALLERGAN INC (US) 1994-04-27 EP disclosed
EP-0422878-B1 (2-Imidazolin-2-ylamino) tetrahydroquinoxalines and methods for using same ALLERGAN INC (US) 1994-04-27 EP disclosed
US-5300504-A Increasing renal fluid flow ALLERGAN, INC. (US) 1994-04-05 US disclosed
US-5300504-A Increasing renal fluid flow ALLERGAN, INC. (US) 1994-04-05 US disclosed
US-5231096-A Methods for using (2-imidazolin-2-ylamino) quinoxaline derivatives ALLERGAN, INC. (US) 1993-07-27 US disclosed
WO-1993013771-A1 METHODS FOR USING (2-IMIDAZOLIN-2-YLAMINO) QUINOXALINE DERIVATIVES ALLERGAN, INC. (US) 1993-07-22 WO disclosed
US-5204347-A Reduction in intraocular pressure; increase renal flow; alteration in the rate of fluid transport in the gastrointestinal tract ALLERGAN, INC. (US) 1993-04-20 US disclosed
US-5204347-A Reduction in intraocular pressure; increase renal flow; alteration in the rate of fluid transport in the gastrointestinal tract ALLERGAN, INC. (US) 1993-04-20 US disclosed
WO-1992013855-A1 (2-IMIDAZOLIN-2-YLAMINO) TETRAHYDROQUINOLAXINES AND METHODS FOR USING SAME ALLERGAN, INC. (US) 1992-08-20 WO disclosed
US-5077292-A Gastrointestinal disordes; kidney and vision defects ALLERGAN, INC. (US) 1991-12-31 US disclosed
EP-0422878-A1 (2-Imidazolin-2-ylamino) tetrahydroquinoxalines and methods for using same ALLERGAN, INC. (US) 1991-04-17 EP disclosed
EP-0422878-A1 (2-Imidazolin-2-ylamino) tetrahydroquinoxalines and methods for using same ALLERGAN, INC. (US) 1991-04-17 EP disclosed