SCHEMBL8798236

SCHEMBL8798236

CCN(CC)C(=O)CCCN(C(=O)Nc1cc(OC)cc(C(C)(C)C)c1O)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
MTNR1A P48039 2/20 0.35
MTNR1B P49286 2/20 0.35
ABCC1 P33527 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 2/20 0.34
NPC1 O15118 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HDAC6 Q9UBN7 3/20 0.34
HDAC1 Q13547 2/20 0.34
RECQL P46063 1/20 0.34
POLB P06746 2/20 0.34
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL8804341 0.87 LMNA (0.34) MEN1KMT2AMTNR1AMTNR1BABCC1
SCHEMBL8799596 0.86 VCAM1 (0.39) MEN1KMT2ACA1CA2MTNR1A
SCHEMBL8799426 0.80 ACHE (0.42) CA1CA2MTNR1AMTNR1BNPC1
SCHEMBL8797685 0.76 HDAC1 (0.34) MEN1KMT2ALMNAHDAC6HDAC1
SCHEMBL3740322 0.74 RAB9A (0.38) CA1CA2LMNANPC1MAPT
SCHEMBL8798368 0.74 SMN1; SMN2 (0.39) KMT2AMTNR1AMTNR1BLMNANPC1
SCHEMBL8798099 0.73 VCAM1 (0.34) MEN1KMT2AMTNR1AMTNR1BLMNA
SCHEMBL281995 0.72 NPC1 (0.39) MEN1KMT2ACA1CA2LMNA
Hydrochloric Acid SCHEMBL6245752 0.71 NPC1 (0.39) MEN1KMT2ACA1CA2LMNA
SCHEMBL8708827 0.69 TSHR (0.56) MEN1KMT2ACA1CA2KDM4E

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
EP-0790240-A1 Phenol-derivatives having pharmaceutical activity and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1997-08-20 EP disclosed