SCHEMBL311154

SCHEMBL311154

CCc1cc(Oc2cc(N)cc(Oc3ccc([N+](=O)[O-])c(CC)c3)c2)ccc1[N+](=O)[O-]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.53
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
ALDH1A1 P00352 7/20 0.49
LMNA P02545 2/20 0.49
HTT P42858 2/20 0.40
TSHR P16473 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
PDE7A Q13946 1/20 0.40
POLB P06746 1/20 0.39
CYP3A4 P08684 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
NLRP3 Q96P20 1/20 0.38
RECQL P46063 1/20 0.38
ALOX15 P16050 1/20 0.37
F2 P00734 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 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
SCHEMBL16316322 0.82 MEN1 (0.44) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL311393 0.82 MEN1 (0.60) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL311726 0.79 MEN1 (0.48) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL310910 0.78 MEN1 (0.47) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL3105068 0.78 SMN1; SMN2 (0.51) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL29763998 0.78 MEN1 (0.47) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL2765848 0.77 TSHR (0.60) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL2767547 0.77 TSHR (0.60) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL22291692 0.76 MAPT (0.69) MAPTMEN1KMT2AALDH1A1LMNA
Bromide SCHEMBL12983645 0.76 TSHR (0.58) MAPTMEN1KMT2AALDH1A1LMNA

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
US-8093349-B2 Terminally modified polybranched polyimide, metal-plated terminally modified polybranched polyimide, and method for producing the same UBE INDUSTRIES, LTD. (JP) 2012-01-10 US disclosed
US-20100009206-A1 TERMINALLY MODIFIED POLYBRANCHED POLYIMIDE, METAL-PLATED TERMINALLY MODIFIED POLYBRANCHED POLYIMIDE, AND METHOD FOR PRODUCING THE SAME UBE INDUSTRIES, LTD. (JP) 2010-01-14 US disclosed