SCHEMBL14337133

SCHEMBL14337133

C/N=C/c1cccc2cc[nH]c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.49
▸ AHR P35869 2/20 0.46
▸ BCHE P06276 3/20 0.41
▸ KEAP1 Q14145 1/20 0.41
▸ NR3C1 P04150 1/20 0.40
▸ PGR P06401 1/20 0.40
▸ NR3C2 P08235 1/20 0.40
▸ AR P10275 1/20 0.40
▸ PDPK1 O15530 1/20 0.40
▸ PRF1 P14222 1/20 0.38
▸ MAPT P10636 5/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ HPGD P15428 1/20 0.35

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
SCHEMBL1420302 0.81 BACE1 (0.53) BACE1AHRBCHEKEAP1NR3C1
SCHEMBL1420307 0.81 BACE1 (0.53) BACE1AHRBCHEKEAP1NR3C1
SCHEMBL3507884 0.81 BACE1 (0.53) BACE1AHRBCHEKEAP1NR3C1
SCHEMBL14337310 0.81 BACE1 (0.49) BACE1AHRBCHEKEAP1NR3C1
SCHEMBL27559246 0.81 BACE1 (0.45) BACE1AHRBCHEKEAP1NR3C1
SCHEMBL8040462 0.79 BACE1 (0.53) BACE1AHRBCHEKEAP1NR3C1
SCHEMBL14337314 0.78 BACE1 (0.43) BACE1AHRBCHEKEAP1NR3C1
SCHEMBL14337031 0.77 BACE1 (0.45) BACE1AHRKEAP1NR3C1PGR
SCHEMBL16689863 0.77 PTGS2 (0.48) BACE1AHRKEAP1NR3C1PGR
SCHEMBL14337502 0.77 BACE1 (0.46) BACE1AHRBCHEKEAP1NR3C1

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
US-7312284-B2 Process for producing polar olefin copolymer and polar olefin copolymer obtained thereby MITSUI CHEMICALS, INC. (JP) 2007-12-25 — — US disclosed
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