SCHEMBL9707103

SCHEMBL9707103

CON(C)C(=O)c1ccc(C)cc1.CON(C)C(=O)c1ccc(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.46
CYP1A2 P05177 2/20 0.46
ACHE P22303 1/20 0.45
KMT2A Q03164 4/20 0.44
MEN1 O00255 1/20 0.44
TDP1 Q9NUW8 2/20 0.44
ALDH1A1 P00352 4/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 2/20 0.42
NFE2L2 Q16236 1/20 0.41
CYP2C19 P33261 1/20 0.41
PAX8 Q06710 1/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
TAS2R14 Q9NYV8 1/20 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
SCHEMBL306600 0.93 MLYCD (0.60) MLYCDSMN1; SMN2CYP1A2KMT2AMEN1
SCHEMBL870352 0.91 MLYCD (0.57) MLYCDSMN1; SMN2KMT2AMEN1TDP1
SCHEMBL9152657 0.86 MLYCD (0.53) MLYCDSMN1; SMN2KMT2AMEN1TDP1
SCHEMBL13694024 0.77 MLYCD (0.48) MLYCDSMN1; SMN2CYP1A2ALDH1A1HSD17B10
SCHEMBL3716405 0.76 MLYCD (0.43) MLYCDCES2CES1
SCHEMBL1012521 0.76 MLYCD (0.57) MLYCDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL22531823 0.76 MLYCD (0.57) MLYCDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL1303906 0.76 MLYCD (0.57) MLYCDSMN1; SMN2KMT2AMEN1TDP1
SCHEMBL4568350 0.75 MLYCD (0.49) MLYCDKMT2AMEN1LMNAL3MBTL1
SCHEMBL5776326 0.75 HDAC1 (0.51) MLYCDKMT2AALDH1A1LMNACES2

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
WO-1992015579-A1 MULTICYCLIC TERTIARY AMINE POLYAROMATIC SQUALENE SYNTHETASE INHIBITORS RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-09-17 WO disclosed