SCHEMBL13875459

SCHEMBL13875459

CC(COCC(C)NC(=O)C(=O)c1ccccc1)NC(=O)C(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
MTNR1A P48039 3/20 0.47
MTNR1B P49286 3/20 0.47
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
XBP1 P17861 1/20 0.43
ATM Q13315 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HPGD P15428 4/20 0.43
ALDH1A1 P00352 3/20 0.43
CES2 O00748 4/20 0.42
CES1 P23141 4/20 0.42
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL13875460 0.86 MEN1 (0.47) MEN1KMT2AMTNR1AMTNR1BRAB9A
SCHEMBL12018317 0.78 CES2 (0.52) RAB9ASMN1; SMN2LMNAMAPTXBP1
SCHEMBL9388831 0.77 SMN1; SMN2 (0.47) MEN1KMT2ARAB9ASMN1; SMN2LMNA
Benzil SCHEMBL28418467 0.77 CES2 (0.56) RAB9ASMN1; SMN2LMNAMAPTXBP1
SCHEMBL23922997 0.74 FOLH1 (0.50) MEN1KMT2ARAB9ANPC1
SCHEMBL14397456 0.74 LMNA (0.54) KMT2ASMN1; SMN2LMNAMAPTXBP1
SCHEMBL24116760 0.73 MTNR1A (0.55) MEN1KMT2AMTNR1AMTNR1BRAB9A
SCHEMBL13753851 0.73 HPGD (0.61) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL12019756 0.73 HPGD (0.61) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL13875465 0.72 HPGD (0.49) MEN1KMT2ASMN1; SMN2HPGDCES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8414982-B2 Process for the production of strongly adherent coatings BASF SE (DE) 2013-04-09 US disclosed
US-8414982-B2 Process for the production of strongly adherent coatings BASF SE (DE) 2013-04-09 US disclosed
US-20090092768-A1 Process for the Production of Strongly Adherent Coatings CIBA SPECIALTY CHEMICALS CORP. 2009-04-09 US disclosed