SCHEMBL7487458

SCHEMBL7487458

N#Cc1ccc(N2CCN(CCCCO)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.53
HRH1 P35367 1/20 0.53
KDM4E B2RXH2 1/20 0.53
TP53 P04637 1/20 0.53
DRD3 P35462 2/20 0.50
KCNH2 Q12809 2/20 0.50
DRD2 P14416 1/20 0.50
HTR7 P34969 2/20 0.49
POLB P06746 1/20 0.49
KCNJ1 P48048 1/20 0.49
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47

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
SCHEMBL7988536 0.89 KDM4E (0.57) HRH3HRH1KDM4ETP53DRD3
SCHEMBL3206275 0.85 CYP2D6 (0.58) HRH3HRH1KDM4ETP53DRD3
SCHEMBL4233204 0.83 DRD2 (0.70) HRH3HRH1KDM4ETP53DRD3
SCHEMBL1714405 0.81 HRH3 (0.74) HRH3HRH1DRD3KCNH2DRD2
SCHEMBL3196892 0.81 POLB (0.52) HRH3HRH1KDM4ETP53DRD3
SCHEMBL1714712 0.81 HRH3 (0.77) HRH3HRH1DRD3KCNH2DRD2
SCHEMBL18396586 0.81 HRH3 (0.52) HRH3HRH1KDM4ETP53DRD3
SCHEMBL6135057 0.80 HRH3 (0.57) HRH3HRH1KDM4ETP53DRD3
SCHEMBL6135382 0.80 HRH3 (0.57) HRH3HRH1KDM4ETP53DRD3
SCHEMBL6135083 0.80 HRH3 (0.57) HRH3HRH1KDM4ETP53DRD3

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-1023287-B1 3-OXO-2(H)-1,2,4-TRIAZINE DERIVATIVES AS LIGANDS OF 5HT1A RECEPTORS PF MEDICAMENT (FR) 2002-06-12 EP disclosed
US-6303603-B1 FOR THEARPY OF ANXIETY, DEPRESSION, SCHIZOPHRENIA PIERRE FABRE MEDICAMENT (FR) 2001-10-16 US disclosed
EP-1023287-A1 3-OXO-2(H)-1,2,4-TRIAZINE DERIVATIVES AS LIGANDS OF 5HT1A RECEPTORS PIERRE FABRE MEDICAMENT (FR) 2000-08-02 EP disclosed
WO-1999020622-A1 3-OXO-2(H)-1,2,4-TRIAZINE DERIVATIVES AS LIGANDS OF 5HT1A RECEPTORS PIERRE FABRE MEDICAMENT (FR) 1999-04-29 WO disclosed