SCHEMBL12473414

SCHEMBL12473414

CN(C)C(CCN)c1nc(-c2cc3cc(Br)ccc3o2)nc2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ TSHR P16473 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ ADRA2A P08913 2/20 0.33
▸ ADRA2B P18089 2/20 0.33
▸ ADRA2C P18825 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ PIM1 P11309 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ MAOB P27338 1/20 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
SCHEMBL12473398 0.89 PDE10A (0.37) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL12473412 0.88 MAOB (0.38) MAPTLMNAALDH1A1NPC1RAB9A
SCHEMBL12473350 0.80 PDE10A (0.39) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL12473319 0.79 PRMT7 (0.35) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL12473410 0.79 PRMT7 (0.35) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL12473432 0.79 PDE10A (0.36) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL12473199 0.78 CNR2 (0.37) MAPTMEN1KMT2ATSHRLMNA
SCHEMBL12473402 0.78 NPC1 (0.41) MAPTKMT2ATSHRLMNAALDH1A1
SCHEMBL12473407 0.78 CNR2 (0.37) MAPTMEN1KMT2ATSHRALDH1A1
SCHEMBL12473403 0.78 BCHE (0.34) MAPTMEN1KMT2ATSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012046207-A1 ANTI-PARASITIC SUBSTITUTED RING FUSED AZINE COMPOUNDS PARACO TECHNOLOGY LIMITED (NZ) 2012-04-12 — — WO disclosed
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