SCHEMBL3356235

SCHEMBL3356235

NC(=O)Cn1ccc2ccc([N+](=O)[O-])cc21

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 1/20 0.50
▸ CDC7 O00311 1/20 0.45
▸ PLG P00747 1/20 0.45
▸ PLAU P00749 1/20 0.45
▸ KRAS P01116 1/20 0.43
▸ AR P10275 1/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ KMT2A Q03164 3/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ PLA2G1B P04054 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ATG4B Q9Y4P1 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ TSHR P16473 2/20 0.39
▸ CCR2 P41597 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ TDP1 Q9NUW8 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
SCHEMBL2873839 0.87 KMT2A (0.54) HTR7CDC7PLGPLAUKRAS
SCHEMBL2870320 0.87 KMT2A (0.54) HTR7CDC7PLGPLAUKRAS
SCHEMBL13139566 0.86 HTR7 (0.53) HTR7CDC7PLGPLAUKRAS
SCHEMBL3356863 0.82 HTR7 (0.50) HTR7CDC7PLGPLAUKRAS
SCHEMBL3354019 0.82 HTR7 (0.50) HTR7KRASARCYP1A2KMT2A
SCHEMBL3356633 0.82 HTR7 (0.50) HTR7CDC7KRASARCYP1A2
SCHEMBL1122247 0.80 ALDH1A1 (0.52) HTR7KMT2ANPC1MAPTLMNA
SCHEMBL1122380 0.79 HTR7 (0.58) HTR7CDC7PLGPLAUAR
SCHEMBL23631701 0.79 KRAS (0.46) HTR7CDC7KRASARKMT2A
SCHEMBL3062365 0.79 HTR7 (0.47) HTR7CDC7KRASARCYP1A2

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
EP-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 — — EP disclosed
EP-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 — — EP disclosed
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