SCHEMBL7766565

SCHEMBL7766565

O=C(ONC(c1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
KMT2A Q03164 3/20 0.53
POLB P06746 2/20 0.53
MAPT P10636 2/20 0.53
TSHR P16473 3/20 0.50
LMNA P02545 2/20 0.48
F2 P00734 1/20 0.48
TP53 P04637 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PKM P14618 1/20 0.44
CASP3 P42574 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
HPGDS O60760 1/20 0.43
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL26461278 0.85 TSHR (0.52) ALDH1A1KMT2APOLBMAPTTSHR
SCHEMBL3496640 0.78 ALDH1A1 (0.68) ALDH1A1KMT2APOLBMAPTTSHR
SCHEMBL8701212 0.78 TSHR (0.47) ALDH1A1KMT2ATSHRLMNATP53
SCHEMBL14370806 0.78 ALDH1A1 (0.46) ALDH1A1KMT2APOLBMAPTTSHR
SCHEMBL23522306 0.77 ALDH1A1 (0.51) ALDH1A1KMT2APOLBMAPTTSHR
SCHEMBL28623032 0.76 TSHR (0.49) ALDH1A1KMT2AMAPTTSHRLMNA
SCHEMBL27727625 0.76 TSHR (0.59) ALDH1A1KMT2APOLBMAPTTSHR
SCHEMBL25582979 0.76 TSHR (0.53) ALDH1A1KMT2APOLBMAPTTSHR
SCHEMBL28370196 0.73 LMNA (0.50) ALDH1A1KMT2ATSHRLMNAL3MBTL1
SCHEMBL28613044 0.73 ATM (0.42) ALDH1A1KMT2ATSHRTP53TDP1

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-1104242-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT RICE CROPS Aventis CropScience GmbH (DE) 2001-06-06 EP disclosed
WO-2000008935-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT RICE CROPS AVENTIS CROPSCIENCE GMBH (DE) 2000-02-24 WO disclosed