SCHEMBL9909074

SCHEMBL9909074

C=C/C=C\C(=C)C(=O)OC(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
F2 P00734 1/20 0.41
TSHR P16473 5/20 0.40
TP53 P04637 1/20 0.40
AKT1 P31749 1/20 0.39
TDP1 Q9NUW8 4/20 0.36
PLA2G7 Q13093 2/20 0.36
PARP10 Q53GL7 1/20 0.36
MAPT P10636 4/20 0.35
ALDH1A1 P00352 4/20 0.35
KMT2A Q03164 3/20 0.35
POLB P06746 2/20 0.35
MAPK1 P28482 1/20 0.35
HIF1A Q16665 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A3 Q01959 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
HSD17B10 Q99714 2/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL20746724 0.81 TSHR (0.41) LMNAF2TSHRTP53AKT1
SCHEMBL25969894 0.77 LMNA (0.41) LMNAF2TSHRTP53AKT1
SCHEMBL8246907 0.77 ELANE (0.41) TDP1PARP10MAPTKMT2AHSD17B10
SCHEMBL27552402 0.75 TDP1 (0.49) LMNAF2TSHRTP53TDP1
SCHEMBL1822836 0.74 LMNA (0.64) LMNAF2TSHRTP53TDP1
SCHEMBL3794632 0.74 ELANE (0.53) LMNAF2TSHRTP53TDP1
SCHEMBL21688900 0.74 BCHE (0.55)
SCHEMBL22407127 0.73 LMNA (0.52) LMNAF2TSHRTP53TDP1
SCHEMBL27825777 0.73 LMNA (0.47) LMNAF2TSHRTP53AKT1
SCHEMBL21064784 0.72 LMNA (0.61) LMNAF2TSHRTP53TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8198435-B2 Crystal form of N-benzoyl-staurosporine NOVARTIS AG (CH) 2012-06-12 US disclosed