SCHEMBL7140276

SCHEMBL7140276

c1cnc(NCCN2CCC(=C3c4sccc4CCn4ccnc43)CC2)nc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.34
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
MKNK1 Q9BUB5 2/20 0.32

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
SCHEMBL7139908 0.84 UTS2R (0.35) HRH1DRD2DRD3
SCHEMBL7142052 0.83 HRH1 (0.38) HRH1DRD2DRD3
SCHEMBL7136336 0.83 HRH1 (0.38) HRH1DRD2DRD3
SCHEMBL7140255 0.82 THRB (0.36) HRH1DRD2DRD3
SCHEMBL7139912 0.81 HRH1 (0.44) HRH1DRD2DRD3
SCHEMBL8931351 0.81 UTS2R (0.35) HRH1DRD3
SCHEMBL9284502 0.80 HRH1 (0.43) HRH1DRD2DRD3
SCHEMBL7144620 0.79 HRH1 (0.38) HRH1DRD2DRD3
Water SCHEMBL7159274 0.79 HRH1 (0.43) HRH1DRD2DRD3
SCHEMBL6999312 0.78 HRH1 (0.61) HRH1MKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672047-B1 ANTIALLERGIC IMIDAZO[1,2-a]THIENO[ 2,3-d]AZEPINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2003-05-02 EP disclosed
US-5629308-A Imidazo [1,2-A] (pyrrolo, thieno or furano) [2,3-D] azepine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1997-05-13 US disclosed
EP-0672047-A1 ANTIALLERGIC IMIDAZO 1,2-a](PYRROLO, THIENO OR FURANO) 2,3-d]AZEPINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1995-09-20 EP disclosed
WO-1994013680-A1 ANTIALLERGIC IMIDAZO[1,2-a](PYRROLO, THIENO OR FURANO)[2,3-d]AZEPINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1994-06-23 WO disclosed