SCHEMBL7005477

SCHEMBL7005477

ClNNCCOc1ncccn1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ HTR1A P08908 1/20 0.32
▸ CHRNB2 P17787 1/20 0.30
▸ CHRNA4 P43681 1/20 0.30

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
SCHEMBL6623288 0.78 ALDH1A1 (0.31) ALDH1A1
SCHEMBL14422893 0.74 HTR1B (0.52) ALDH1A1CHRNB2CHRNA4
SCHEMBL30740922 0.71 HTR1B (0.46) HTR1ACHRNB2CHRNA4
SCHEMBL5422564 0.70 ALDH1A1 (0.46) ALDH1A1
SCHEMBL14562245 0.67 MTNR1A (0.59) ALDH1A1
SCHEMBL11548891 0.66 DRD4 (0.66) —
SCHEMBL4280446 0.66 NPC1 (0.46) ALDH1A1
SCHEMBL18265853 0.66 HDAC8 (0.35) —
SCHEMBL5859016 0.66 TAAR1 (0.46) —
SCHEMBL15547011 0.66 HDAC8 (0.35) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1289994-A1 PROCESS FOR THE PREPARATION OF 2-AMINO-5,8-DIMETHOXY 1,2,4]TRIAZOLO 1,5-c]PYRIMIDINE Dow AgroSciences LLC (US) 2003-03-12 — — EP disclosed
WO-2001098305-A1 PROCESS FOR THE PREPARATION OF 2-AMINO-5,8-DIMETHOXY[1,2,4]TRIAZOLO[1,5-c]PYRIMIDINE DOW AGROSCIENCES LLC (US) 2001-12-27 — — WO disclosed
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