SCHEMBL8744233

SCHEMBL8744233

CCCCC(CC)CC(=O)N1CCN(C(=O)CC(CC)CCCC)C1=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.41
ALDH1A1 P00352 5/20 0.40
CYP3A4 P08684 4/20 0.38
TSHR P16473 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.36
NAAA Q02083 2/20 0.36
FAAH O00519 1/20 0.36
RECQL P46063 1/20 0.35
BCL2L1 Q07817 1/20 0.35
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.34
USP2 O75604 1/20 0.33

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
SCHEMBL22202009 0.71 L3MBTL1 (0.54) TDP1ATML3MBTL1LMNA
SCHEMBL11980515 0.70 CA2 (0.61) CA2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL5046988 0.70 ALDH1A1 (0.56) CA2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL4440711 0.69 ALDH1A1 (0.54) CA2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL140442 0.69 ALDH1A1 (0.54) CA2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL375165 0.69 ALDH1A1 (0.54) CA2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL9176596 0.69 ALDH1A1 (0.54) CA2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL6761797 0.69 ALDH1A1 (0.54) CA2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL22798418 0.69 LMNA (0.38) CA2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL10617533 0.67 ALDH1A1 (0.52) CA2ALDH1A1CYP3A4TSHRTDP1

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
EP-0492847-B1 Air curing polymer composition ROHM & HAAS (US) 1997-01-22 EP disclosed
US-5559192-A Air curing polymer compositions ROHM AND HAAS COMPANY (US) 1996-09-24 US disclosed