SCHEMBL27332913

SCHEMBL27332913

Nc1ccnc(C2CC2)c1C(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ MAPT P10636 4/20 0.41
▸ GAA P10253 2/20 0.41
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.38
▸ TNK2 Q07912 3/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PBRM1 Q86U86 1/20 0.37
▸ HDAC3 O15379 1/20 0.36
▸ HDAC4 P56524 1/20 0.36
▸ HDAC7 Q8WUI4 1/20 0.36
▸ HDAC8 Q9BY41 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ HDAC9 Q9UKV0 1/20 0.36
▸ HDAC5 Q9UQL6 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ LMNA P02545 3/20 0.36
▸ 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
SCHEMBL27336625 0.94 HTT (0.52) HTTHSD17B10MAPTGAAKMT2A
SCHEMBL17938153 0.84 HTT (0.39) HTTHSD17B10MAPTKMT2AMEN1
SCHEMBL27632867 0.74 GSK3B (0.37) HTTHSD17B10MAPTKMT2AMEN1
SCHEMBL27332910 0.73 HTT (0.59) HTTHSD17B10MAPTGAAKMT2A
Hydrochloric Acid SCHEMBL27393238 0.73 HTT (0.59) HTTHSD17B10MAPTGAAKMT2A
SCHEMBL927943 0.70 NCF1 (0.34) HTTHSD17B10MAPTGAAKMT2A
SCHEMBL28135536 0.70 ALDH1A1 (0.62) HTTHSD17B10MAPTGAAKMT2A
SCHEMBL27370005 0.70 HTT (0.55) HTTHSD17B10MAPTGAAKMT2A
SCHEMBL11858611 0.68 MAPT (0.65) HTTHSD17B10MAPTGAAKMT2A
SCHEMBL31364062 0.67 TNK2 (0.44) MAPTGAAALDH1A1TNK2L3MBTL1

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
CN-1043993-C Nonel naphthyridine derivatives and medical composition thereof YAMANOUCHI PHARMA CO LTD (JP) 1999-07-07 — — CN disclosed
CN-1156455-A Nonel naphthyridine derivatives and medical composition thereof YAMANOUCHI PHARMACUEITCAL CO L (JP) 1997-08-06 — — CN disclosed
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