SCHEMBL16091912

SCHEMBL16091912

CCn1c2ccccc2c2cc(/C=C/c3cc[n+](CCCCS(=O)(=O)O)cc3)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.48
▸ POLB P06746 5/20 0.48
▸ HTT P42858 3/20 0.48
▸ PKM P14618 1/20 0.48
▸ BCHE P06276 3/20 0.47
▸ ACHE P22303 3/20 0.47
▸ SRC P12931 4/20 0.44
▸ MEN1 O00255 6/20 0.43
▸ KMT2A Q03164 6/20 0.43
▸ ALDH1A1 P00352 8/20 0.43
▸ HPGD P15428 7/20 0.43
▸ SMN1; SMN2 Q16637 6/20 0.43
▸ LMNA P02545 6/20 0.43
▸ MAPT P10636 6/20 0.43
▸ HSD17B10 Q99714 2/20 0.42
▸ USP2 O75604 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ PLK1 P53350 1/20 0.41
▸ RCE1 Q9Y256 1/20 0.41

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
SCHEMBL16183131 0.86 BCHE (0.53) KDM4EPOLBHTTPKMBCHE
SCHEMBL16091909 0.84 APP (0.54) KDM4EPOLBHTTPKMBCHE
SCHEMBL16183139 0.83 BCHE (0.62) KDM4EPOLBHTTPKMBCHE
SCHEMBL16183130 0.82 POLB (0.49) KDM4EPOLBHTTPKMBCHE
SCHEMBL14392967 0.79 BCHE (0.53) KDM4EPOLBHTTPKMBCHE
SCHEMBL85408 0.78 KDM4E (0.68) KDM4EPOLBHTTPKMBCHE
SCHEMBL29415213 0.78 KDM4E (0.68) KDM4EPOLBHTTPKMBCHE
SCHEMBL29357702 0.78 KDM4E (0.68) KDM4EPOLBHTTPKMBCHE
SCHEMBL3443606 0.78 KDM4E (0.68) KDM4EPOLBHTTPKMBCHE
SCHEMBL16676902 0.77 BCHE (0.45) KDM4EPOLBHTTPKMBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210063405-A1 METHODS FOR DYE SELECTION FOR PROTEIN MELT TEMPERATURE DETERMINATIONS Life Technologies Corporation 2021-03-04 — — US disclosed
US-10024863-B2 Methods for dye selection for protein melt temperature determinations Life Technologies Corporation (US) 2018-07-17 — — US disclosed
US-20140315190-A1 METHODS FOR DYE SELECTION FOR PROTEIN MELT TEMPERATURE DETERMINATIONS Life Technologies Corporation 2014-10-23 — — US disclosed
WO-2014144360-A2 METHODS FOR DYE SELECTION FOR PROTEIN MELT TEMPERATURE DETERMINATIONS Life Technologies Corporation (US) 2014-09-18 — — WO disclosed
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