SCHEMBL7046801

SCHEMBL7046801

COC(COc1ccc(-c2ccccc2)cc1)OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.48
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
LSS P48449 1/20 0.47
MAPT P10636 2/20 0.47
HTT P42858 1/20 0.47
PPARG P37231 1/20 0.47
PPARD Q03181 1/20 0.47
PPARA Q07869 1/20 0.47
LMNA P02545 2/20 0.46
CHRNA7 P36544 2/20 0.45
CHRNB2 P17787 1/20 0.45
CHRNB4 P30926 1/20 0.45
CHRNA3 P32297 1/20 0.45
CHRNA4 P43681 1/20 0.45
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 2/20 0.42

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
SCHEMBL7089376 0.88 LMNA (0.57) MAOALMNA
SCHEMBL7816346 0.85 LTA4H (0.57) MAOAPPARGPPARDPPARALMNA
SCHEMBL28274981 0.81 LMNA (0.56) MAOAMAOBMAPTLMNASMN1; SMN2
SCHEMBL1602489 0.81 RAB9A (0.47) KDM1AMAOAMAOBLSSMAPT
SCHEMBL14672093 0.80 MAPT (0.57) KDM1AMAOAMAOBLSSMAPT
SCHEMBL7931690 0.79 CYP2C9 (0.60) MAPTHTTMEN1KMT2A
SCHEMBL17996498 0.78 TSHR (0.47) MAPTLMNASMN1; SMN2NPC1MEN1
SCHEMBL17947648 0.77 MAOA (0.50) KDM1AMAOAMAOBLSSMAPT
SCHEMBL155771 0.77 LMNA (0.78) KDM1AMAOAMAOBLSSMAPT
SCHEMBL9513813 0.77 LMNA (0.78) KDM1AMAOAMAOBLSSMAPT

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-0874808-B1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LAB (US) 2003-04-09 EP disclosed
EP-0874808-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 1998-11-04 EP disclosed
US-5665777-A ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1997-09-09 US disclosed
WO-1997018188-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1997-05-22 WO disclosed