SCHEMBL8200481

SCHEMBL8200481

NC(=O)CCCCC1(C(N)=O)CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
CYP2C19 P33261 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
TBXAS1 P24557 2/20 0.35
CETP P11597 4/20 0.33
CPB2 Q96IY4 5/20 0.32
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 1/20 0.31
BLM P54132 1/20 0.31
CACNA2D1 P54289 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KMT2A Q03164 1/20 0.30
TARDBP Q13148 1/20 0.30

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
SCHEMBL9284588 1.00 CYP4F2 (0.40) CYP4F2CYP4A11CYP2C19L3MBTL1TBXAS1
SCHEMBL275955 1.00 CYP4F2 (0.40) CYP4F2CYP4A11CYP2C19L3MBTL1TBXAS1
SCHEMBL10884457 0.98 CYP4F2 (0.42) CYP4F2CYP4A11CYP2C19L3MBTL1TBXAS1
SCHEMBL17870572 0.98 CYP4F2 (0.42) CYP4F2CYP4A11CYP2C19L3MBTL1TBXAS1
SCHEMBL277422 0.98 CYP4F2 (0.42) CYP4F2CYP4A11CYP2C19L3MBTL1TBXAS1
SCHEMBL11035397 0.98 CYP4F2 (0.42) CYP4F2CYP4A11CYP2C19L3MBTL1TBXAS1
SCHEMBL277732 0.98 CYP4F2 (0.42) CYP4F2CYP4A11CYP2C19L3MBTL1TBXAS1
SCHEMBL278023 0.98 CYP4F2 (0.42) CYP4F2CYP4A11CYP2C19L3MBTL1TBXAS1
SCHEMBL251232 0.98 CYP4F2 (0.42) CYP4F2CYP4A11CYP2C19L3MBTL1TBXAS1
SCHEMBL15520905 0.98 CYP4F2 (0.42) CYP4F2CYP4A11CYP2C19L3MBTL1TBXAS1

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-6022918-A POLYETHYLENE WAX HAVING A MOLECULAR MASS OF FROM 3000 TO 6000 G/MOL, AND A WETTING AGENT, COMPRISING A FATTY ALCOHOL ETHOXYLATE. BASF COATINGS AG (DE) 2000-02-08 US disclosed
US-5084304-A Heat resistant coating applied to a metal, a heat resistant material polymer such as a blend of a polyesterimide, a polyhydantoin, a polyamide, a polyamideimide copolymer and a polybismaleimide BASF LACKE & FARBEN AG (DE) 1992-01-28 US disclosed