SCHEMBL8549042

SCHEMBL8549042

O=C1C(=Cc2ccc([N+](=O)[O-])cc2)CCc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 1.00
RAB9A P51151 5/20 1.00
CASP3 P42574 2/20 1.00
SENP8 Q96LD8 2/20 1.00
SENP7 Q9BQF6 2/20 1.00
SENP6 Q9GZR1 2/20 1.00
SMN1; SMN2 Q16637 2/20 1.00
ALDH1A1 P00352 4/20 0.74
LMNA P02545 1/20 0.74
HPGD P15428 1/20 0.74
MAOB P27338 2/20 0.68
MIF P14174 7/20 0.66
GAA P10253 1/20 0.65
CYP19A1 P11511 3/20 0.62
PKM P14618 2/20 0.62
CYP11B2 P19099 1/20 0.62
MAPK1 P28482 1/20 0.62
NPC1 O15118 4/20 0.57
KDM4E B2RXH2 1/20 0.57
KMT2A Q03164 2/20 0.56

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
SCHEMBL8549041 1.00 MAPT (1.00) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL7000855 0.87 MAPT (0.78) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL7000852 0.87 MAPT (0.78) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL8547623 0.85 MAPT (1.00) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL8547627 0.85 MAPT (1.00) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL14033869 0.82 MAOB (0.81) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL820654 0.82 MAOB (1.00) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL29679848 0.82 MAOB (1.00) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL29546087 0.82 MAOB (1.00) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL29546151 0.82 MAOB (1.00) MAPTRAB9ACASP3SENP8SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0557075-B1 4H-naphtho 1,2-b pyran derivatives as antiproliferative agents LILLY CO ELI (GB) 1998-06-24 EP disclosed
US-5663375-A CELL PROLIFERATION ELI LILLY AND COMPANY (US) 1997-09-02 US disclosed
US-5622987-A PREVENT MIGRATION OR PROLIFERATION OF SMOOTH MUSCLE CELLS ELI LILLY AND COMPANY (US) 1997-04-22 US disclosed
US-5378699-A Treatment of immune diseases, cell proliferation, restenosis and smooth muscle cells LILLY INDUSTRIES LIMITED (GB) 1995-01-03 US disclosed
US-5378717-A Therapy for diabetic complications ELI LILLY AND COMPANY (US) 1995-01-03 US disclosed
EP-0557075-A1 4H-naphtho 1,2-b pyran derivatives as antiproliferative agents LILLY INDUSTRIES LIMITED (GB) 1993-08-25 EP disclosed