SCHEMBL20380853

SCHEMBL20380853

CCn1c2ccccc2c2cc(/C=C/c3sc4ccccc4[n+]3C)ccc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 3/20 0.62
▸ ACHE P22303 3/20 0.62
▸ KDM4E B2RXH2 5/20 0.53
▸ HTT P42858 3/20 0.53
▸ POLB P06746 1/20 0.53
▸ PKM P14618 1/20 0.53
▸ INSR P06213 2/20 0.50
▸ ALDH1A1 P00352 5/20 0.48
▸ HPGD P15428 5/20 0.48
▸ LMNA P02545 4/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ MAPT P10636 3/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ USP2 O75604 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ CASP1 P29466 1/20 0.48
▸ SRC P12931 4/20 0.48
▸ SNCA P37840 1/20 0.47
▸ APP P05067 1/20 0.45
▸ MEN1 O00255 3/20 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
SCHEMBL29357702 0.80 KDM4E (0.68) BCHEACHEKDM4EHTTPOLB
SCHEMBL3443606 0.80 KDM4E (0.68) BCHEACHEKDM4EHTTPOLB
SCHEMBL29415213 0.80 KDM4E (0.68) BCHEACHEKDM4EHTTPOLB
SCHEMBL85408 0.80 KDM4E (0.68) BCHEACHEKDM4EHTTPOLB
SCHEMBL1105637 0.80 BCHE (0.48) BCHEACHEKDM4EHTTPOLB
SCHEMBL20380421 0.79 POLB (0.58) BCHEACHEKDM4EHTTPOLB
SCHEMBL16183130 0.79 POLB (0.49) BCHEACHEKDM4EHTTPOLB
SCHEMBL10013256 0.79 KDM4E (0.67) BCHEACHEKDM4EHTTPOLB
SCHEMBL133176 0.77 KDM4E (0.65) BCHEACHEKDM4EHTTPOLB
SCHEMBL133177 0.77 KDM4E (0.65) BCHEACHEKDM4EHTTPOLB

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
US-10866245-B2 Methods for dye selection for protein melt temperature determinations Life Technologies Corporation (US) 2020-12-15 — — US disclosed
US-10024863-B2 Methods for dye selection for protein melt temperature determinations Life Technologies Corporation (US) 2018-07-17 — — US disclosed
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