SCHEMBL27633442

SCHEMBL27633442

CCOc1cc2cc3nc(cc4ccc(cc5nc(cc1[nH]2)C=C5)[nH]4)C=C3

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.36
▸ PDE5A O76074 1/20 0.35
▸ STAT3 P40763 1/20 0.35
▸ STAT1 P42224 1/20 0.35
▸ CBFB Q13951 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ NFKB2 Q00653 1/20 0.33
▸ RELA Q04206 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ GUSB P08236 2/20 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
SCHEMBL27524397 0.87 MAPT (0.34) MAPTPDE5ASTAT3STAT1CBFB
SCHEMBL30497518 0.83 STAT3 (0.37) MAPTSTAT3STAT1ALDH1A1SMN1; SMN2
SCHEMBL480532 0.83 STAT3 (0.37) MAPTSTAT3STAT1ALDH1A1SMN1; SMN2
SCHEMBL28470756 0.81 STAT3 (0.36) MAPTSTAT3STAT1ALDH1A1SMN1; SMN2
SCHEMBL7156706 0.80 HTR1B (0.34) STAT3STAT1
SCHEMBL27894257 0.80 PDE4A (0.41) MAPTPDE5ASTAT3STAT1SMN1; SMN2
SCHEMBL7163065 0.79 STAT3 (0.32) STAT3STAT1
SCHEMBL7163047 0.79 STAT3 (0.32) STAT3STAT1
Ether SCHEMBL5339884 0.79 STAT3 (0.34) STAT3STAT1CBFB
SCHEMBL7156701 0.78 STAT3 (0.31) STAT3STAT1

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
CN-1723134-A Security feature for products or product packaging SUN CHEMICAL BV (NL) 2006-01-18 — — CN disclosed
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