SCHEMBL9397158

SCHEMBL9397158

C=CC(=O)NC(C)(C)CCC(C)C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 3/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
TSHR P16473 3/20 0.41
ALOX15 P16050 1/20 0.36
TDP1 Q9NUW8 2/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.32
PIK3CD O00329 1/20 0.32
HTT P42858 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31

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
SCHEMBL7115211 0.91 MEN1 (0.48) MEN1KMT2AALDH1A1CYP3A4CYP2C9
SCHEMBL27548933 0.87 MEN1 (0.48) MEN1KMT2AALDH1A1CYP3A4CYP2C9
SCHEMBL1073217 0.81 ALDH1A1 (0.49) MEN1KMT2AALDH1A1CYP3A4CYP2C9
SCHEMBL19881271 0.81 MEN1 (0.38) MEN1KMT2AALDH1A1CYP3A4CYP2C9
SCHEMBL9398466 0.81 TSHR (0.37) MEN1KMT2AALDH1A1CYP3A4CYP2C9
SCHEMBL20467953 0.79 MEN1 (0.53) MEN1KMT2AALDH1A1CYP3A4CYP2C9
SCHEMBL4906709 0.79 KMT2A (0.53) MEN1KMT2AALDH1A1CYP3A4CYP2C9
SCHEMBL736116 0.79 MEN1 (0.53) MEN1KMT2AALDH1A1CYP3A4CYP2C9
SCHEMBL15448877 0.79 MEN1 (0.53) MEN1KMT2AALDH1A1CYP3A4CYP2C9
SCHEMBL1018029 0.78 MEN1 (0.49) MEN1KMT2AALDH1A1CYP3A4CYP2C9

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
EP-3284599-B1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND LITHOGRAPHIC PRINTING METHOD USING THE SAME FUJIFILM CORP (JP) 2019-07-03 EP disclosed
US-5275811-A Terpolymer resin of vinyl ester, acrylamide and maleate ISP INVESTMENTS INC. (US) 1994-01-04 US disclosed
US-5196495-A Hair spray; terpolymer of a vinyl ester, alkyl maleate half ester and a substituted acrylamide ISP INVESTMENTS INC. (US) 1993-03-23 US disclosed
WO-1992013014-A1 HAIR FIXATIVE POLYMERS ISP INVESTMENTS INC. (US) 1992-08-06 WO disclosed