SCHEMBL8998992

SCHEMBL8998992

CCOC(=O)C(C)C(c1ccccc1)c1ccc(C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.49
PIN1 Q13526 1/20 0.45
LMNA P02545 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
KMT2A Q03164 1/20 0.44
KEAP1 Q14145 4/20 0.44
NFE2L2 Q16236 4/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRB2 P47870 2/20 0.44
CYP11B1 P15538 2/20 0.44
CYP11B2 P19099 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ABCB11 O95342 1/20 0.44
GABRA2 P47869 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
Bicarbonate SCHEMBL28193127 0.92 MMP8 (0.53) MMP8PIN1LMNAMEN1NPC1
SCHEMBL8998813 0.84 MMP8 (0.47) MMP8PIN1LMNAMEN1NPC1
SCHEMBL5084136 0.81 LMNA (0.55) MMP8PIN1LMNAMEN1NPC1
SCHEMBL16477715 0.80 MMP8 (0.54) MMP8PIN1LMNAMEN1NPC1
SCHEMBL9126861 0.80 MMP8 (0.54) MMP8PIN1LMNAMEN1NPC1
SCHEMBL13751893 0.80 MMP8 (0.54) MMP8PIN1LMNAMEN1NPC1
SCHEMBL25600199 0.78 MMP8 (0.53) MMP8PIN1MEN1NPC1KMT2A
SCHEMBL10910013 0.78 MEN1 (0.46) MMP8PIN1LMNAMEN1NPC1
SCHEMBL15216694 0.77 MMP8 (0.51) MMP8PIN1MEN1NPC1KMT2A
SCHEMBL27813870 0.77 MMP8 (0.51) MMP8PIN1MEN1NPC1KMT2A

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-5554624-A CONGESTIVE HEART FAILURE; HYPOTENSIVE AGENTS J. URIACH & CIA. (ES) 1996-09-10 US disclosed
EP-0669333-A1 New imidazopyridine derivatives as angiotensin II antagonists J. URIACH & CIA. S.A. (ES) 1995-08-30 EP disclosed