SCHEMBL8115993

SCHEMBL8115993

CSc1cccc(COCCCO)c1[N+](=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ LMNA P02545 1/20 0.33
▸ ALDH1A1 P00352 6/20 0.32
▸ MAPT P10636 3/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ HPGD P15428 3/20 0.31
▸ CA2 P00918 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ PRKD3 O94806 1/20 0.31
▸ MAP4K4 O95819 1/20 0.31
▸ CDK1 P06493 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31

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
SCHEMBL8838485 0.83 ALDH1A1 (0.49) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL8118510 0.79 KMT2A (0.45) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL8106323 0.75 KMT2A (0.37) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL28041429 0.71 NPC1 (0.38) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL6653342 0.70 TDP1 (0.50) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL8838615 0.70 KMT2A (0.36) KMT2AMEN1ALDH1A1MAPTTDP1
SCHEMBL6653015 0.69 ALDH1A1 (0.49) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL6653987 0.68 ALDH1A1 (0.47) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL27946164 0.68 ALDH1A1 (0.38) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL3025068 0.68 PDE7A (0.46) KMT2AMEN1LMNAALDH1A1MAPT

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-0632036-B1 Amide derivatives having anti-hypercholesteremic activity, their preparation and their therapeutic uses SANKYO CO (JP) 2000-03-01 — — EP disclosed
US-5614550-A ANTICHOLESTEROL AGENTS OR ARTERIOSCLEROSIS AGENTS FOR HUMANS SANKYO COMPANY, LIMITED (JP) 1997-03-25 — — US disclosed
US-5534529-A Substituted aromatic amides and ureas derivatives having anti-hypercholesteremic activity, their preparation and their therapeutic uses SANKYO COMPANY, LIMITED (JP) 1996-07-09 — — US disclosed
EP-0632036-A2 Amide and urea derivatives having anti-hypercholesteremic activity, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1995-01-04 — — EP disclosed
Send feedback