SCHEMBL17617812

SCHEMBL17617812

CC(C)Sc1ccc2c3c(cccc13)C(=O)N(OS(=O)(=O)CC13CCC(CC1=O)C3(C)C)C2=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
CXCR3 P49682 1/20 0.41
ALDH1A1 P00352 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA5A P35218 2/20 0.39
CA5B Q9Y2D0 2/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL13829355 0.87 MEN1 (0.38) KMT2AMEN1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL13829256 0.87 KMT2A (0.41) KMT2AMEN1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL13829353 0.86 KMT2A (0.41) KMT2AMEN1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL13829354 0.86 KMT2A (0.42) KMT2AMEN1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL13829115 0.85 KMT2A (0.40) KMT2AMEN1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL13829097 0.85 CXCR3 (0.40) KMT2AMEN1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL13829141 0.84 KMT2A (0.41) KMT2AMEN1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL4545352 0.84 KMT2A (0.50) KMT2AMEN1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL18962226 0.84 KMT2A (0.50) KMT2AMEN1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL13829095 0.84 KMT2A (0.39) KMT2AMEN1SMN1; SMN2CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3182203-A1 A COMBINATION OF NIT DERIVATIVES WITH SENSITIZERS Heraeus Precious Metals North America Daychem LLC (US) 2017-06-21 EP disclosed
US-9383644-B2 Sulfonic acid derivative compounds as photoacid generators in resist applications Heraeus Precious Metals North America Daychem LLC (US) 2016-07-05 US disclosed
US-9383644-B2 Sulfonic acid derivative compounds as photoacid generators in resist applications Heraeus Precious Metals North America Daychem LLC (US) 2016-07-05 US disclosed
US-20160085148-A1 SULFONIC ACID DERIVATIVE COMPOUNDS AS PHOTOACID GENERATORS IN RESIST APPLICATIONS HERAEUS EPURIO LLC 2016-03-24 US disclosed
US-20160085148-A1 SULFONIC ACID DERIVATIVE COMPOUNDS AS PHOTOACID GENERATORS IN RESIST APPLICATIONS HERAEUS EPURIO LLC 2016-03-24 US disclosed
WO-2016043941-A1 SULFONIC DERIVATIVE COMPOUNDS AS PHOTOACID GENERATORS IN RESIST APPLICATIONS Heraeus Precious Metals North America Daychem LLC (US) 2016-03-24 WO disclosed