SCHEMBL30970189

SCHEMBL30970189

Cc1cc(Oc2cc(Oc3ccc([N+](=O)[O-])c(C)c3)cc(Oc3ccc([N+](=O)[O-])c(C)c3)c2)ccc1[N+](=O)[O-]

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
POLB P06746 1/20 0.51
TSHR P16473 2/20 0.50
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 6/20 0.47
HTT P42858 2/20 0.47
HSD17B10 Q99714 1/20 0.47
KDM4E B2RXH2 3/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
HPGD P15428 1/20 0.45
GAA P10253 1/20 0.44

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
SCHEMBL311393 0.92 MEN1 (0.60) MAPTMEN1KMT2AL3MBTL1POLB
SCHEMBL2538774 0.89 TSHR (0.52) MAPTMEN1KMT2AL3MBTL1POLB
SCHEMBL28708372 0.89 MEN1 (0.49) MAPTMEN1KMT2AL3MBTL1POLB
SCHEMBL443483 0.88 HSD17B10 (0.52) MAPTMEN1KMT2AL3MBTL1POLB
SCHEMBL6180876 0.88 MERTK (0.52) MAPTMEN1KMT2AL3MBTL1POLB
SCHEMBL30072571 0.88 HSD17B10 (0.52) MAPTMEN1KMT2AL3MBTL1POLB
SCHEMBL6567485 0.87 PIN1 (0.52) MAPTMEN1KMT2AL3MBTL1POLB
SCHEMBL7862606 0.86 PDE7A (0.49) MAPTMEN1KMT2AL3MBTL1POLB
SCHEMBL2531644 0.86 HSPB1 (0.57) MAPTMEN1KMT2AL3MBTL1POLB
SCHEMBL20240569 0.86 TSHR (0.49) MAPTMEN1KMT2AL3MBTL1POLB

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
WO-2024141320-A1 RADIATION CURABLE LIQUID COMPOSITION, PROCESS OF FORMING 3D-PRINTED OBJECT AND 3D-PRINTED OBJECT BASF SE (DE) 2024-07-04 WO disclosed
WO-2024141321-A1 PHOTOCURABLE HYPERBRANCHED POLYIMIDE AND PREPARATION PROCESS THEREOF BASF SE (DE) 2024-07-04 WO disclosed