SCHEMBL11147292

SCHEMBL11147292

CCCN1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)C(=O)N(CCC)C1=S

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.50
▸ APP P05067 4/20 0.50
▸ SNCA P37840 4/20 0.50
▸ METAP1 P53582 1/20 0.48
▸ AMY1A P0DUB6 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ ALDH1A1 P00352 5/20 0.43
▸ LMNA P02545 4/20 0.43
▸ AKR1B1 P15121 1/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ PLIN1 O60240 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ PLIN5 Q00G26 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ ABHD5 Q8WTS1 1/20 0.43
▸ POLB P06746 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42

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
SCHEMBL11142869 0.90 MAPT (0.51) MAPTAPPSNCAMETAP1AMY1A
SCHEMBL11148683 0.82 METAP1 (0.53) MAPTAPPSNCAMETAP1AMY1A
SCHEMBL11153567 0.76 MAPT (0.43) MAPTTDP1ALDH1A1LMNAKMT2A
SCHEMBL11149380 0.76 METAP1 (0.49) MAPTAPPSNCAMETAP1AMY1A
SCHEMBL11146842 0.75 NR1H4 (0.60) MAPTMETAP1ALDH1A1LMNAAKR1B1
SCHEMBL11146269 0.72 MEN1 (0.58) MAPTAPPSNCAMETAP1AMY1A
SCHEMBL125192 0.71 KMT2A (0.64) MAPTAPPSNCAMETAP1TDP1
SCHEMBL11147680 0.71 TNFRSF1A (0.44) MAPTTDP1ALDH1A1LMNAKMT2A
SCHEMBL8090142 0.71 ACHE (0.62) ALDH1A1KMT2AMEN1
SCHEMBL14015181 0.70 ALDH1A1 (0.54) MAPTTDP1ALDH1A1LMNAKMT2A

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-4389477-A Photoconductive composition sensitized by a thiobarbituric acid derivative FUJI PHOTO FILM CO., LTD. (JP) 1983-06-21 — — US disclosed
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