SCHEMBL7484572

SCHEMBL7484572

Cn1nc(Cc2ccccc2)c(OCCCCN2CCN(c3ncccn3)CC2)nc1=O

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 5/20 0.48
▸ HTR1A P08908 3/20 0.47
▸ ABCB1 P08183 3/20 0.47
▸ MAOB P27338 3/20 0.44
▸ DRD2 P14416 3/20 0.44
▸ HTR2A P28223 2/20 0.43
▸ HTR7 P34969 1/20 0.43
▸ HTR6 P50406 1/20 0.43

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
SCHEMBL7490567 0.84 HRH3 (0.49) HRH3HTR1AMAOBDRD2HTR2A
SCHEMBL7488508 0.82 HRH3 (0.51) HRH3HTR1AMAOBDRD2HTR2A
SCHEMBL7485995 0.73 HTR1A (0.54) HRH3HTR1AMAOBDRD2HTR2A
SCHEMBL7488037 0.72 HTR1A (0.53) HRH3HTR1AMAOBDRD2HTR2A
SCHEMBL7488133 0.71 HTR1A (0.50) HRH3HTR1AABCB1HTR7
SCHEMBL26492991 0.67 HTR1A (0.65) HRH3HTR1ADRD2HTR2AHTR7
SCHEMBL26108581 0.67 HTR1A (0.65) HRH3HTR1ADRD2HTR2AHTR7
Hydrochloric Acid SCHEMBL10561281 0.66 HTR1A (0.61) HTR1ADRD2HTR2AHTR7
Hydrochloric Acid SCHEMBL26108377 0.66 DRD2 (0.63) HTR1ADRD2HTR2A
Fumaric Acid SCHEMBL7488718 0.65 HRH3 (0.49) HRH3HTR1AMAOBDRD2HTR2A

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 6 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 claimed
US-6303603-B1 FOR THEARPY OF ANXIETY, DEPRESSION, SCHIZOPHRENIA PIERRE FABRE MEDICAMENT (FR) 2001-10-16 — — US claimed
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
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