SCHEMBL8075328

SCHEMBL8075328

O=C(O)CCC[CH]CCCCC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
MAPT P10636 3/20 0.58
ABCC4 O15439 1/20 0.58
TSHR P16473 1/20 0.58
NFKB1 P19838 1/20 0.58
PMP22 Q01453 1/20 0.58
SLC22A6 Q4U2R8 1/20 0.53
PPARG P37231 4/20 0.52
TERT O14746 3/20 0.52
PTPN1 P18031 3/20 0.52
PPARD Q03181 3/20 0.52
PPARA Q07869 3/20 0.52
TOP1 P11387 3/20 0.52
BLM P54132 2/20 0.52
HSD17B10 Q99714 2/20 0.52
FABP4 P15090 2/20 0.52
F7 P08709 2/20 0.52
F3 P13726 2/20 0.52
GMNN O75496 1/20 0.52
USP2 O75604 1/20 0.52

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
SCHEMBL7863631 0.97 LMNA (0.65) LMNAMAPTABCC4TSHRNFKB1
SCHEMBL8671826 0.94 LMNA (0.67) LMNAMAPTABCC4TSHRNFKB1
SCHEMBL10971650 0.94 LMNA (0.67) LMNAMAPTABCC4TSHRNFKB1
SCHEMBL11583701 0.94 LMNA (0.59) LMNAMAPTABCC4TSHRNFKB1
SCHEMBL8459757 0.85 GPR84 (0.73) LMNAMAPTABCC4TSHRNFKB1
SCHEMBL7784335 0.85 PPARG (0.73) LMNAMAPTTSHRSLC22A6PPARG
SCHEMBL7786847 0.85 TOP1 (0.70) LMNAMAPTTSHRSLC22A6PPARG
SCHEMBL6391712 0.84 LMNA (0.55) LMNAMAPTABCC4TSHRNFKB1
SCHEMBL9400239 0.84 CAMK2A (0.55) LMNAMAPTABCC4TSHRNFKB1
SCHEMBL15367506 0.84 F7 (0.77) LMNAMAPTTSHRSLC22A6PPARG

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-6110957-A ANTITUMOR AGENT TREATING CELL PROLIFERATIVE DISORDERS SUCH AS CANCER, DYES, FUNGICIDES, BACTERICIDES SUGEN, INC. (US) 2000-08-29 US disclosed
US-5786488-A DEHYDROBROMINATION OF A DIBROMOBENZOQUINONES WITH AT LEAST ONE INDOLES IN A POLAR SOLVENT AND A METAL CARBONATE TO FORM AN ANTITUMOR AGENT SUGEN, INC. (US) 1998-07-28 US disclosed