SCHEMBL8940387

SCHEMBL8940387

O=C(Oc1cc2c3cc(OC(=O)c4ccccc4)c(OC(=O)c4ccccc4)cc3c3cc(OC(=O)c4ccccc4)c(OC(=O)c4ccccc4)cc3c2cc1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.62
MAPT P10636 5/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
MEN1 O00255 4/20 0.58
ESR1 P03372 2/20 0.58
ESR2 Q92731 2/20 0.58
HSD17B10 Q99714 2/20 0.58
JAK2 O60674 1/20 0.58
USP2 O75604 1/20 0.58
GAA P10253 1/20 0.58
ALOX15 P16050 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
CA12 O43570 1/20 0.56
CA9 Q16790 1/20 0.56
SLC6A3 Q01959 1/20 0.55
LMNA P02545 2/20 0.54
F2 P00734 1/20 0.54
TDP1 Q9NUW8 2/20 0.53
TSHR P16473 1/20 0.50
PARP1 P09874 1/20 0.50

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
SCHEMBL17430808 0.88 KMT2A (0.60) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL10036520 0.85 KMT2A (0.67) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL725404 0.84 KMT2A (0.76) KMT2AMAPTSMN1; SMN2MEN1ESR1
Hydrochloric Acid SCHEMBL16050041 0.82 KMT2A (0.73) KMT2AMAPTSMN1; SMN2MEN1ESR1
Bromide SCHEMBL29588519 0.82 KMT2A (0.73) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL29208966 0.82 KMT2A (0.56) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL13661081 0.81 CA12 (0.52) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL24808008 0.80 TSHR (0.62) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL5162057 0.80 ESR1 (0.73) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL2483331 0.79 MAPT (0.53) KMT2AMAPTSMN1; SMN2MEN1ESR1

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
JP-8048976-A None JP disclosed
JP-H0848976-A TRIPHENYLENE DERIVATIVE MIXTURE FUJI PHOTO FILM CO LTD 1996-02-20 JP disclosed