SCHEMBL279043

SCHEMBL279043

CCc1ccc(-c2ccc(CC)cc2[N+](=O)[O-])cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 1/20 0.47
MAPT P10636 6/20 0.46
ALDH1A1 P00352 5/20 0.42
LMNA P02545 4/20 0.42
KMT2A Q03164 4/20 0.42
TDP1 Q9NUW8 3/20 0.42
MEN1 O00255 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GAA P10253 1/20 0.42
ALPG P10696 1/20 0.42
ABCB1 P08183 2/20 0.42
NPBWR1 P48145 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 2/20 0.41
PTGES O14684 2/20 0.41
NPC1 O15118 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
EGFR P00533 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL29864477 1.00 KAT2B (0.47) KAT2BMAPTALDH1A1LMNAKMT2A
SCHEMBL279052 0.90 ALDH1A1 (0.56) KAT2BMAPTALDH1A1LMNAKMT2A
SCHEMBL17468329 0.83 ALDH1A1 (0.65) MAPTALDH1A1LMNAKMT2ATDP1
SCHEMBL18612200 0.81 GCGR (0.44) MAPTALDH1A1ABCB1SMN1; SMN2PTGES
SCHEMBL10979945 0.80 GCGR (0.48) MAPTALDH1A1KMT2AMEN1
SCHEMBL10959235 0.80 TSHR (0.55) KAT2BMAPTALDH1A1LMNAKMT2A
SCHEMBL30869160 0.78 PDK1 (0.53) KAT2BMAPTALDH1A1LMNAKMT2A
SCHEMBL30869161 0.78 PDK1 (0.53) KAT2BMAPTALDH1A1LMNAKMT2A
SCHEMBL11753424 0.78 PDK1 (0.53) KAT2BMAPTALDH1A1LMNAKMT2A
SCHEMBL28184988 0.77 ADAMTS4 (0.42) MAPTALDH1A1LMNAKMT2ATDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240150502-A1 BIPHENYLPHENOL POLYMERIZATION CATALYSTS DOW GLOBAL TECHNOLOGIES LLC (US) 2024-05-09 US disclosed
EP-4291585-A1 BIPHENYLPHENOL POLYMERIZATION CATALYSTS Dow Global Technologies LLC (US) 2023-12-20 EP disclosed
US-8134143-B2 2,7-carbazolenevinylene derivatives as novel materials in producing organic based electronic devices NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2012-03-13 US disclosed
US-20070176163-A1 2,7-Carbazolenevinylene derivatives as novel materials in producing organic based electronic devices NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2007-08-02 US disclosed