SCHEMBL16183115

SCHEMBL16183115

CCCCCN(CCCCC)c1ccc(C=Cc2ccc3ccccc3[n+]2CCCCS(=O)(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 4/20 0.49
▸ MEN1 O00255 5/20 0.48
▸ KMT2A Q03164 5/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ POLB P06746 3/20 0.48
▸ LMNA P02545 2/20 0.48
▸ HTT P42858 2/20 0.48
▸ BLM P54132 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ PPARG P37231 1/20 0.48
▸ NCOA2 Q15596 1/20 0.48
▸ NCOA1 Q15788 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ BCHE P06276 3/20 0.47
▸ ACHE P22303 3/20 0.47
▸ KDM4A O75164 3/20 0.41
▸ KDM2A Q9Y2K7 3/20 0.41
▸ APP P05067 3/20 0.40

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
SCHEMBL20380419 0.91 MEN1 (0.57) INSRMEN1KMT2ARAB9APOLB
SCHEMBL14984184 0.80 KDM4A (0.58) INSRMEN1KMT2ARAB9ALMNA
SCHEMBL14562210 0.80 ACHE (0.71) INSRMEN1KMT2ARAB9APOLB
SCHEMBL16183112 0.79 KDM4A (0.62) INSRMEN1KMT2ARAB9AHTT
SCHEMBL18102243 0.79 KDM4A (0.62) INSRMEN1KMT2ARAB9AHTT
SCHEMBL10035998 0.79 MEN1 (0.72) INSRMEN1KMT2ARAB9APOLB
SCHEMBL30670643 0.79 APP (0.42) MEN1KMT2ARAB9APOLBLMNA
SCHEMBL18102271 0.78 APP (0.44) INSRMEN1KMT2ARAB9ALMNA
SCHEMBL13629539 0.78 CHRM2 (0.61) INSRMEN1KMT2AHTTBLM
SCHEMBL455654 0.77 CHRM2 (0.52) INSRMEN1KMT2ARAB9ALMNA

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-20140315190-A1 METHODS FOR DYE SELECTION FOR PROTEIN MELT TEMPERATURE DETERMINATIONS Life Technologies Corporation 2014-10-23 — — US disclosed
Send feedback