SCHEMBL8106520

SCHEMBL8106520

Cc1ccccc1C1(c2ccccc2C)CC(=O)CC(=O)C1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.41
HDAC4 P56524 1/20 0.39
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 2/20 0.35
ACHE P22303 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 4/20 0.34
PKM P14618 1/20 0.34
CYP1A2 P05177 1/20 0.33
ELANE P08246 1/20 0.33
HSD11B1 P28845 1/20 0.33
HSD11B2 P80365 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
PDE7A Q13946 1/20 0.33
CYP3A4 P08684 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL8118617 0.76 TP53 (0.43) OPRM1HDAC4TSHRCYP1A2PDE7A
SCHEMBL8124069 0.76 HTR2A (0.34) MAPTMEN1KMT2ACYP1A2HSD11B1
SCHEMBL8105577 0.76 KMT2A (0.44) OPRM1MAPTKMT2ATDP1ALDH1A1
SCHEMBL8116256 0.70 MEN1 (0.56) OPRM1MAPTMEN1KMT2ATSHR
SCHEMBL16868731 0.70 S100A4 (0.43) MAPTMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL8609713 0.68 HDAC4 (0.50) OPRM1HDAC4TSHRACHEHSD11B1
SCHEMBL11096498 0.68 MEN1 (0.40) OPRM1HDAC4MEN1KMT2ASMN1; SMN2
Iodide SCHEMBL11093787 0.67 MEN1 (0.39) OPRM1HDAC4MEN1KMT2ASMN1; SMN2
SCHEMBL11475250 0.67 HDAC4 (0.35) OPRM1HDAC4MAPTTSHRACHE
SCHEMBL8117721 0.67 MAOB (0.36) OPRM1MAPTMEN1KMT2AACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114546-A Aminomethylene derivatives and ultraviolet absorbent comprising thereof CHEMIPRO KASEI KAISHA, LIMITED (JP) 2000-09-05 US disclosed
EP-0950655-A1 AMINOMETHYLENE DERIVATIVES AND ULTRAVIOLET ABSORBER COMPRISING THE SAME CHEMIPRO KASEI KAISHA, LIMITED (JP) 1999-10-20 EP disclosed