SCHEMBL10598917

SCHEMBL10598917

NC(=O)CC(=O)N(c1ccccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 1/20 0.47
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ ALDH1A1 P00352 5/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PLAU P00749 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ F2 P00734 1/20 0.38
▸ PRSS1 P07477 1/20 0.38
▸ PRSS2 P07478 1/20 0.38
▸ PRSS3 P35030 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ GPR35 Q9HC97 1/20 0.38

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
SCHEMBL29006882 0.80 PLAU (0.46) CTSDKMT2AMEN1ALDH1A1MAPT
SCHEMBL7261915 0.79 PLAU (0.45) CTSDKMT2AMEN1ALDH1A1KDM4E
SCHEMBL27311079 0.76 PLAU (0.42) CTSDKMT2AMEN1ALDH1A1MAPT
SCHEMBL1821316 0.75 CTSD (0.44) CTSDKMT2AMEN1ALDH1A1KDM4E
SCHEMBL8428777 0.75 ALDH1A1 (0.42) CTSDKMT2AMEN1ALDH1A1MAPT
SCHEMBL11036917 0.74 ALDH1A1 (0.50) CTSDKMT2AMEN1ALDH1A1KDM4E
SCHEMBL9818604 0.74 NPC1 (0.43) CTSDKMT2AMEN1ALDH1A1KDM4E
SCHEMBL28424914 0.74 HSD17B10 (0.51) CTSDKMT2AMEN1ALDH1A1KDM4E
SCHEMBL29063387 0.73 CYP1A2 (0.38) KMT2AMEN1ALDH1A1KDM4E
SCHEMBL8669115 0.73 PLAU (0.46) CTSDKMT2AMEN1ALDH1A1KDM4E

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
EP-0121326-B1 ALKANEDIYL BRIDGED BENZIMIDAZOLO MONOMETHINE CYANINE DYES, PROCESSES FOR THEIR PREPARATION, AND PHOTOGRAPHIC EMULSIONS AND ELEMENTS CONTAINING SUCH DYES EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1989-05-17 — — EP claimed
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