SCHEMBL10936766

SCHEMBL10936766

CC(=O)C(=Cc1cccc2nonc12)[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ LMNA P02545 1/20 0.40
▸ KMT2A Q03164 10/20 0.40
▸ MEN1 O00255 9/20 0.40
▸ POLB P06746 3/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ KEAP1 Q14145 1/20 0.40
▸ NFE2L2 Q16236 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.37
▸ CASP3 P42574 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ MCL1 Q07820 1/20 0.37
▸ SENP8 Q96LD8 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ SENP6 Q9GZR1 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ARNT P27540 4/20 0.36

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
SCHEMBL10939130 1.00 MAPT (0.40) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL10996988 0.88 KMT2A (0.40) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL10996992 0.88 KMT2A (0.40) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL11045441 0.80 KMT2A (0.39) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL11045438 0.80 KMT2A (0.39) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL7271751 0.77 KDM4E (0.38) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL6232523 0.77 KDM4E (0.38) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL6232530 0.77 KDM4E (0.38) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL4800575 0.74 MAPT (0.41) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL10729247 0.74 MAPT (0.41) MAPTALDH1A1KMT2AMEN1POLB

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-1985001940-A1 DERIVATIVES OF 1,4-DIHYDROPYRIDINE, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANDOZ AG (CH) 1985-05-09 — — WO disclosed
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