SCHEMBL7201735

SCHEMBL7201735

[CH2]CCNCC1CCc2ccccc2O1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 14/20 0.64
HTR1D P28221 14/20 0.64
CA2 P00918 1/20 0.57

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
SCHEMBL27478384 1.00 HTR1A (0.64) HTR1AHTR1DCA2
SCHEMBL8970632 0.85 HTR1A (0.64) HTR1AHTR1DCA2
SCHEMBL8052654 0.83 HTR1A (0.66) HTR1AHTR1DCA2
SCHEMBL8864373 0.83 HTR1A (0.66) HTR1AHTR1DCA2
SCHEMBL27471154 0.82 HTR1A (0.60) HTR1AHTR1DCA2
SCHEMBL8879867 0.82 HTR1A (0.60) HTR1AHTR1DCA2
SCHEMBL8049371 0.82 HTR1A (0.60) HTR1AHTR1DCA2
SCHEMBL5723599 0.81 HTR1A (0.67) HTR1AHTR1DCA2
SCHEMBL7309998 0.79 HTR1A (0.57) HTR1AHTR1DCA2
SCHEMBL8864160 0.79 DRD2 (0.72) HTR1AHTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0714396-B1 VASOCONTRICTIVE DIHYDROBENZOPYRAN DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2003-12-10 EP claimed
CN-1052006-C Dihydrobenzopyran derivatives as vasoconstrictors, preparation and use thereof JANSSEN PHARMACEUTICA NV (NL) 2000-05-03 CN claimed
CN-1129451-A Dihydrobenzopyran derivatives as vasoconstrictors JANSSEN PHARMACEUTICA NV (BE) 1996-08-21 CN claimed
CN-1155597-C Benzodioxan, benzofuran or benzopyranl derivatives having fundic relaxation properties ղɭҩҵ���޹�˾ 2004-06-30 CN disclosed
EP-0714396-B1 VASOCONTRICTIVE DIHYDROBENZOPYRAN DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2003-12-10 EP disclosed
CN-1280577-A Benzodioxan, benzofuran or benzopyranl derivatives having fundic relaxation properties JANSSEN PHARMACEUTICA NV (BE) 2001-01-17 CN disclosed
CN-1052006-C Dihydrobenzopyran derivatives as vasoconstrictors, preparation and use thereof JANSSEN PHARMACEUTICA NV (NL) 2000-05-03 CN disclosed
CN-1129451-A Dihydrobenzopyran derivatives as vasoconstrictors JANSSEN PHARMACEUTICA NV (BE) 1996-08-21 CN disclosed